N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine

C17H26N4 — CID 103499447

IUPACN-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCNCc1c(N2CCC(C(C)C)CC2)nc2ccccn12
InChIInChI=1S/C17H26N4/c1-13(2)14-7-10-20(11-8-14)17-15(12-18-3)21-9-5-4-6-16(21)19-17/h4-6,9,13-14,18H,7-8,10-12H2,1-3H3
InChIKeyVMQNJKXGJWKEPH-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.93
Rot. Bonds4

About N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine

N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 103499447) has the molecular formula C17H26N4 and a molecular weight of 286.42 g/mol. Its IUPAC name is N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound NameN-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID103499447
Molecular FormulaC17H26N4
Molecular Weight286.42 g/mol
Exact Mass286.22
IUPAC NameN-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCNCc1c(N2CCC(C(C)C)CC2)nc2ccccn12
InChIInChI=1S/C17H26N4/c1-13(2)14-7-10-20(11-8-14)17-15(12-18-3)21-9-5-4-6-16(21)19-17/h4-6,9,13-14,18H,7-8,10-12H2,1-3H3
InChIKeyVMQNJKXGJWKEPH-UHFFFAOYSA-N
XLogP2.93
TPSA32.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-dimethyl-1-[3-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]pyrrolidin-3-amine
CID 63164894
1-[2-(1,3-dihydroisoindol-2-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 62205742
1-[2-(3-methoxy-4-methylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]-N-methylmethanamine
CID 102961210
N-methyl-1-[2-(1,4-thiazepan-4-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 61419254
3-methyl-1-[3-(methylaminomethyl)imidazo[1,2-a]pyridin-2-yl]pyrrolidin-3-ol
CID 103356941
N-methyl-1-[2-(2-propylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 83045362
N-[[2-(4-methylpiperazin-1-yl)imidazo[1,2-a]pyridin-3-yl]methyl]cyclopropanamine
CID 43478186
N-methyl-1-(2-pyrazol-1-ylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 43478544
N-[(2-thiomorpholin-4-ylimidazo[1,2-a]pyridin-3-yl)methyl]cyclopropanamine
CID 43478365
N-methyl-1-(2-methylsulfanylimidazo[1,2-a]pyridin-3-yl)methanamine
CID 63814200
1-[3-(bromomethyl)imidazo[1,2-a]pyridin-2-yl]-N,N-dimethylpiperidin-4-amine
CID 107080536
3-(bromomethyl)-2-(4-methylsulfanylpiperidin-1-yl)imidazo[1,2-a]pyridine
CID 114237430

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine (CID 103499447) is N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine is CNCc1c(N2CCC(C(C)C)CC2)nc2ccccn12.
What is the InChIKey of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is VMQNJKXGJWKEPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N4/c1-13(2)14-7-10-20(11-8-14)17-15(12-18-3)21-9-5-4-6-16(21)19-17/h4-6,9,13-14,18H,7-8,10-12H2,1-3H3.
What are the key properties of N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine?
N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 286.42 g/mol, XLogP of 2.93, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-[2-(4-propan-2-ylpiperidin-1-yl)imidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 103499447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).