N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine

C15H24ClN3 — CID 62281197

IUPACN-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cnc(N2CCCCC2)c(Cl)c1
InChIInChI=1S/C15H24ClN3/c1-15(2,3)18-11-12-9-13(16)14(17-10-12)19-7-5-4-6-8-19/h9-10,18H,4-8,11H2,1-3H3
InChIKeyHLNGFIOBKZPAOW-UHFFFAOYSA-N
MW281.83 g/mol
LogP3.61
Rot. Bonds3

About N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine

N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine (PubChem CID 62281197) has the molecular formula C15H24ClN3 and a molecular weight of 281.83 g/mol. Its IUPAC name is N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine.

Molecular Properties

Compound NameN-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine
PubChem CID62281197
Molecular FormulaC15H24ClN3
Molecular Weight281.83 g/mol
Exact Mass281.17
IUPAC NameN-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine
SMILESCC(C)(C)NCc1cnc(N2CCCCC2)c(Cl)c1
InChIInChI=1S/C15H24ClN3/c1-15(2,3)18-11-12-9-13(16)14(17-10-12)19-7-5-4-6-8-19/h9-10,18H,4-8,11H2,1-3H3
InChIKeyHLNGFIOBKZPAOW-UHFFFAOYSA-N
XLogP3.61
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.83
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[5-chloro-6-(1-oxo-1,4-thiazinan-4-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62293525
N-[[6-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-2-yl)-5-chloro-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 115562045
N-[[5-chloro-6-(4-methyl-3,6-dihydro-2H-pyridin-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 114412745
N-[[5-chloro-6-(2,2-dimethylpyrrolidin-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 63218000
N-[[5-chloro-6-(3,3-dimethylmorpholin-4-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62293326
N-[[5-chloro-6-(4,5-dimethylimidazol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62351844
N-[(5-chloro-6-thiomorpholin-4-yl-3-pyridinyl)methyl]propan-2-amine
CID 62280716
N-[[5-chloro-6-(4-methyl-1,4-diazepan-1-yl)-3-pyridinyl]methyl]cyclopropanamine
CID 62279476
N-[[5-chloro-6-(4,4-dimethylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 62930984
N-[[5-chloro-6-(4-propan-2-ylpiperidin-1-yl)-3-pyridinyl]methyl]propan-2-amine
CID 103502958
N-[[5-chloro-6-(3-cyclopropylpyrazol-1-yl)-3-pyridinyl]methyl]-2-methylpropan-2-amine
CID 62491063
[6-(4-tert-butylpiperidin-1-yl)-5-chloro-3-pyridinyl]methanol
CID 62091450

Frequently Asked Questions

What is the IUPAC name of N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine?
The IUPAC name of N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine (CID 62281197) is N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine.
What is the SMILES notation for N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine?
The canonical SMILES for N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine is CC(C)(C)NCc1cnc(N2CCCCC2)c(Cl)c1.
What is the InChIKey of N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine?
The InChIKey is HLNGFIOBKZPAOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24ClN3/c1-15(2,3)18-11-12-9-13(16)14(17-10-12)19-7-5-4-6-8-19/h9-10,18H,4-8,11H2,1-3H3.
What are the key properties of N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine?
N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine has a molecular weight of 281.83 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine is sourced from PubChem (CID 62281197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).