6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine

C17H18ClFN6 — CID 118164360

IUPAC6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
SMILESCc1c(Cl)nc(-c2cnc3ccc(F)cn23)nc1N[C@@H]1CCCNC1
InChIInChI=1S/C17H18ClFN6/c1-10-15(18)23-17(24-16(10)22-12-3-2-6-20-7-12)13-8-21-14-5-4-11(19)9-25(13)14/h4-5,8-9,12,20H,2-3,6-7H2,1H3,(H,22,23,24)/t12-/m1/s1
InChIKeyJHVVLSXJFZKJCS-GFCCVEGCSA-N
MW360.82 g/mol
LogP3.06
Rot. Bonds3

About 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine

6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine (PubChem CID 118164360) has the molecular formula C17H18ClFN6 and a molecular weight of 360.82 g/mol. Its IUPAC name is 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
PubChem CID118164360
Molecular FormulaC17H18ClFN6
Molecular Weight360.82 g/mol
Exact Mass360.13
IUPAC Name6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
SMILESCc1c(Cl)nc(-c2cnc3ccc(F)cn23)nc1N[C@@H]1CCCNC1
InChIInChI=1S/C17H18ClFN6/c1-10-15(18)23-17(24-16(10)22-12-3-2-6-20-7-12)13-8-21-14-5-4-11(19)9-25(13)14/h4-5,8-9,12,20H,2-3,6-7H2,1H3,(H,22,23,24)/t12-/m1/s1
InChIKeyJHVVLSXJFZKJCS-GFCCVEGCSA-N
XLogP3.06
TPSA67.14 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.82
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
CID 141298973
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-methoxy-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
CID 67262133
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-N-(2-methoxyethyl)-4-N-[(3R)-piperidin-3-yl]pyrimidine-4,6-diamine
CID 86692691
5-fluoro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-(4-phenylmethoxypiperidin-1-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
CID 118164385
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-(2-morpholin-4-ylethoxy)-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
CID 86692699
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]-6-(1,2,4-triazol-1-yl)pyrimidin-4-amine;2,2,2-trifluoroacetic acid
CID 162312720
N-ethyl-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine
CID 67241991
2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-[[(3R)-piperidin-3-yl]methoxy]-5-(trifluoromethyl)pyrimidin-4-amine
CID 70922035
ethane;2-[3-[5-fluoro-6-(piperidin-3-ylamino)-2-pyridinyl]imidazo[1,2-a]pyrazin-6-yl]propan-2-ol
CID 170646421
N-[(3R)-piperidin-3-yl]-6-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]pyrazin-2-amine
CID 58303489
3-[[5-fluoro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-6-(3-hydroxyazetidin-1-yl)pyrimidin-4-yl]amino]piperidine-1-carboxylic acid
CID 118164328
(2S)-2-[3-[3,5-difluoro-6-[[(3R)-pyrrolidin-3-yl]amino]-2-pyridinyl]imidazo[1,2-a]pyridin-6-yl]-1,1,1-trifluoropropan-2-ol
CID 169129503

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
The IUPAC name of 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine (CID 118164360) is 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine.
What is the SMILES notation for 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
The canonical SMILES for 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine is Cc1c(Cl)nc(-c2cnc3ccc(F)cn23)nc1N[C@@H]1CCCNC1.
What is the InChIKey of 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
The InChIKey is JHVVLSXJFZKJCS-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H18ClFN6/c1-10-15(18)23-17(24-16(10)22-12-3-2-6-20-7-12)13-8-21-14-5-4-11(19)9-25(13)14/h4-5,8-9,12,20H,2-3,6-7H2,1H3,(H,22,23,24)/t12-/m1/s1.
What are the key properties of 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine?
6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine has a molecular weight of 360.82 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-(6-fluoroimidazo[1,2-a]pyridin-3-yl)-5-methyl-N-[(3R)-piperidin-3-yl]pyrimidin-4-amine is sourced from PubChem (CID 118164360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).