6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine

C17H23N3 — CID 103937054

IUPAC6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(C)Cc2cccc(C)c2)cn1
InChIInChI=1S/C17H23N3/c1-4-16(18)17-9-8-15(11-19-17)20(3)12-14-7-5-6-13(2)10-14/h5-11,16H,4,12,18H2,1-3H3/t16-/m0/s1
InChIKeyWCTDTEXGMVCMPO-INIZCTEOSA-N
MW269.39 g/mol
LogP3.44
Rot. Bonds5

About 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine

6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine (PubChem CID 103937054) has the molecular formula C17H23N3 and a molecular weight of 269.39 g/mol. Its IUPAC name is 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine
PubChem CID103937054
Molecular FormulaC17H23N3
Molecular Weight269.39 g/mol
Exact Mass269.19
IUPAC Name6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(C)Cc2cccc(C)c2)cn1
InChIInChI=1S/C17H23N3/c1-4-16(18)17-9-8-15(11-19-17)20(3)12-14-7-5-6-13(2)10-14/h5-11,16H,4,12,18H2,1-3H3/t16-/m0/s1
InChIKeyWCTDTEXGMVCMPO-INIZCTEOSA-N
XLogP3.44
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.39
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-[(1R)-1-aminoethyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 83122827
N-methyl-6-[1-(methylamino)ethyl]-N-[(3-methylphenyl)methyl]pyridin-3-amine
CID 83122660
6-(1-aminopropyl)-N-methyl-N-[(2-methylfuran-3-yl)methyl]pyridin-3-amine
CID 112584270
6-[(1S)-1-aminopropyl]-N-methyl-N-propylpyridin-3-amine
CID 103936975
6-[(1S)-1-aminopropyl]-N-[(2-bromophenyl)methyl]-N-methylpyridin-3-amine
CID 103937072
1-[5-[(3-methylphenyl)methylsulfanyl]-2-pyridinyl]propan-1-amine
CID 112585115
6-(1-aminopropyl)-N-(2,2-dimethylpropyl)-N-methylpyridin-3-amine
CID 112584377
6-[(1R)-1-aminopropyl]-N-methyl-N-(2-thiophen-2-ylethyl)pyridin-3-amine
CID 103937486
6-[(1S)-1-aminopropyl]-N-methyl-N-(1,3-thiazol-4-ylmethyl)pyridin-3-amine
CID 103937223
6-(1-aminopropyl)-N-benzyl-N-propan-2-ylpyridin-3-amine
CID 115939177
1-[5-[methyl-[(4-methylphenyl)methyl]amino]-2-pyridinyl]propan-1-ol
CID 115940380
6-[(1R)-1-aminopropyl]-N-(cyclopropylmethyl)-N-methylpyridin-3-amine
CID 103937043

Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine?
The IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine (CID 103937054) is 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine.
What is the SMILES notation for 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine?
The canonical SMILES for 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine is CC[C@H](N)c1ccc(N(C)Cc2cccc(C)c2)cn1.
What is the InChIKey of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine?
The InChIKey is WCTDTEXGMVCMPO-INIZCTEOSA-N. The full InChI is InChI=1S/C17H23N3/c1-4-16(18)17-9-8-15(11-19-17)20(3)12-14-7-5-6-13(2)10-14/h5-11,16H,4,12,18H2,1-3H3/t16-/m0/s1.
What are the key properties of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine?
6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine has a molecular weight of 269.39 g/mol, XLogP of 3.44, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-aminopropyl]-N-methyl-N-[(3-methylphenyl)methyl]pyridin-3-amine is sourced from PubChem (CID 103937054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).