N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine

C19H23N5O — CID 155411920

IUPACN-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine
SMILESCN1CCC(COc2cnc(Nc3ccc4[nH]ccc4c3)nc2)CC1
InChIInChI=1S/C19H23N5O/c1-24-8-5-14(6-9-24)13-25-17-11-21-19(22-12-17)23-16-2-3-18-15(10-16)4-7-20-18/h2-4,7,10-12,14,20H,5-6,8-9,13H2,1H3,(H,21,22,23)
InChIKeyYSAPXOSYVUVKNP-UHFFFAOYSA-N
MW337.43 g/mol
LogP3.42
Rot. Bonds5

About N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine

N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine (PubChem CID 155411920) has the molecular formula C19H23N5O and a molecular weight of 337.43 g/mol. Its IUPAC name is N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine.

Molecular Properties

Compound NameN-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine
PubChem CID155411920
Molecular FormulaC19H23N5O
Molecular Weight337.43 g/mol
Exact Mass337.19
IUPAC NameN-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine
SMILESCN1CCC(COc2cnc(Nc3ccc4[nH]ccc4c3)nc2)CC1
InChIInChI=1S/C19H23N5O/c1-24-8-5-14(6-9-24)13-25-17-11-21-19(22-12-17)23-16-2-3-18-15(10-16)4-7-20-18/h2-4,7,10-12,14,20H,5-6,8-9,13H2,1H3,(H,21,22,23)
InChIKeyYSAPXOSYVUVKNP-UHFFFAOYSA-N
XLogP3.42
TPSA66.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.43
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(1-methylpiperidin-4-yl)methoxy]-1H-pyrrolo[2,3-b]pyridine
CID 59774841
4-N-(3-aminophenyl)-5-fluoro-2-N-[4-[(1-methylpiperidin-4-yl)methoxy]phenyl]pyrimidine-2,4-diamine
CID 59174590
N-(2-methyl-1,3-dihydroisoindol-5-yl)-1H-indol-5-amine
CID 82536098
2-[3-methyl-4-(1-methylpiperidin-4-yl)oxyanilino]-6H-pyrido[4,3-d]pyrimidin-5-one
CID 175961168
1-methyl-4-[(4-methylphenoxy)methyl]piperidine
CID 123249578
(2R,3S)-N-[5-(1H-indol-5-yl)pyrimidin-2-yl]-2-methyl-1-azabicyclo[2.2.2]octan-3-amine
CID 67491722
12-[(1-methylpiperidin-4-yl)methoxy]-5,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene-4-carbonitrile
CID 58266586
N-(4-ethyl-2-pyridinyl)-1H-indol-5-amine
CID 155412453
2-N-[3,4-bis(2-methoxyethoxy)phenyl]-4-N-(1H-indol-5-yl)-1,3,5-triazine-2,4-diamine
CID 23536381
3-[(1-methylpiperidin-4-yl)methoxy]benzonitrile
CID 68710696
N-(4-methylphenyl)-1H-indol-5-amine
CID 58867969
N-(1H-indol-5-yl)-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazolin-4-amine
CID 22030671

Frequently Asked Questions

What is the IUPAC name of N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine?
The IUPAC name of N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine (CID 155411920) is N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine.
What is the SMILES notation for N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine?
The canonical SMILES for N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine is CN1CCC(COc2cnc(Nc3ccc4[nH]ccc4c3)nc2)CC1.
What is the InChIKey of N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine?
The InChIKey is YSAPXOSYVUVKNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N5O/c1-24-8-5-14(6-9-24)13-25-17-11-21-19(22-12-17)23-16-2-3-18-15(10-16)4-7-20-18/h2-4,7,10-12,14,20H,5-6,8-9,13H2,1H3,(H,21,22,23).
What are the key properties of N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine?
N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine has a molecular weight of 337.43 g/mol, XLogP of 3.42, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]-1H-indol-5-amine is sourced from PubChem (CID 155411920), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).