5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine

C18H24FN7O — CID 71014689

IUPAC5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine
SMILESFc1cnc(Nc2ccc(N3CCOCC3)nc2)nc1NC1CCCNC1
InChIInChI=1S/C18H24FN7O/c19-15-12-22-18(25-17(15)23-13-2-1-5-20-10-13)24-14-3-4-16(21-11-14)26-6-8-27-9-7-26/h3-4,11-13,20H,1-2,5-10H2,(H2,22,23,24,25)
InChIKeyOERAEHXRCCPYFT-UHFFFAOYSA-N
MW373.44 g/mol
LogP1.75
Rot. Bonds5

About 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine

5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine (PubChem CID 71014689) has the molecular formula C18H24FN7O and a molecular weight of 373.44 g/mol. Its IUPAC name is 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine.

Molecular Properties

Compound Name5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine
PubChem CID71014689
Molecular FormulaC18H24FN7O
Molecular Weight373.44 g/mol
Exact Mass373.20
IUPAC Name5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine
SMILESFc1cnc(Nc2ccc(N3CCOCC3)nc2)nc1NC1CCCNC1
InChIInChI=1S/C18H24FN7O/c19-15-12-22-18(25-17(15)23-13-2-1-5-20-10-13)24-14-3-4-16(21-11-14)26-6-8-27-9-7-26/h3-4,11-13,20H,1-2,5-10H2,(H2,22,23,24,25)
InChIKeyOERAEHXRCCPYFT-UHFFFAOYSA-N
XLogP1.75
TPSA87.23 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.44
LogP ≤ 51.75
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

Buparlisib
CID 16654980
(S)-4-(Difluoromethyl)-5-(4-(3-methylmorpholino)-6-morpholino-1,3,5-triazin-2-yl)pyridin-2-amine
CID 121334433
5-(2-Morpholin-4-Yl-7-Pyridin-3-Yl-6,7-Dihydro-5h-Pyrrolo[2,3-D]pyrimidin-4-Yl)-Pyrimidin-2-Ylamine
CID 24889936
6-[4-[6-[(4,4-dimethylpiperidin-1-yl)methyl]pyridin-3-yl]-1-oxa-4,9-diazaspiro[5.5]undecan-9-yl]-N-(phenylmethyl)pyrimidin-4-amine
CID 156587340
Pqr626
CID 121334440
4-(difluoromethyl)-5-[4-(3,3-dimethylmorpholin-4-yl)-6-[(3R)-3-methylmorpholin-4-yl]-1,3,5-triazin-2-yl]pyridin-2-amine
CID 121334501
2-[4-(Morpholino)anilino]-4-(1-isopropyl-2-methyl-1H-imidazol-5-yl)-5-fluoropyrimidine
CID 11315446
N2-(3,5-dimorpholinophenyl)-N4-methyl-N4-phenylpyrimidine-2,4-diamine
CID 25014762
2-[4-(Morpholino)anilino]-4-(1-isopropyl-2-methyl-1h-imidazol-5-yl)pyrimidine
CID 44578651
N~4~-[4-(Morpholin-4-Yl)phenyl]-N~6~-(Pyridin-3-Ylmethyl)pyrido[3,2-D]pyrimidine-4,6-Diamine
CID 73386687
2-N-(2,4-difluorophenyl)-6-N-[5-[4-(dimethylamino)piperidin-1-yl]-2-pyridinyl]-4-morpholin-4-ylpyrido[3,4-d]pyrimidine-2,6-diamine
CID 145971580
2-morpholino-7-(3-(trifluoromethyl)pyridin-2-yl)-N-(5-(trifluoromethyl)pyridin-2-yl)-6,7,8,9-tetrahydro-5H-pyrimido[5,4-d]azepin-4-amine
CID 24783656

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine?
The IUPAC name of 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine (CID 71014689) is 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine.
What is the SMILES notation for 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine?
The canonical SMILES for 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine is Fc1cnc(Nc2ccc(N3CCOCC3)nc2)nc1NC1CCCNC1.
What is the InChIKey of 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine?
The InChIKey is OERAEHXRCCPYFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24FN7O/c19-15-12-22-18(25-17(15)23-13-2-1-5-20-10-13)24-14-3-4-16(21-11-14)26-6-8-27-9-7-26/h3-4,11-13,20H,1-2,5-10H2,(H2,22,23,24,25).
What are the key properties of 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine?
5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine has a molecular weight of 373.44 g/mol, XLogP of 1.75, 5 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-N-(6-morpholin-4-yl-3-pyridinyl)-4-N-piperidin-3-ylpyrimidine-2,4-diamine is sourced from PubChem (CID 71014689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).