(2S)-2-methyl-2,3-dihydropyridin-3-amine;propane

C9H18N2 — CID 143817204

IUPAC(2S)-2-methyl-2,3-dihydropyridin-3-amine;propane
SMILESCCC.C[C@@H]1N=CC=CC1N
InChIInChI=1S/C6H10N2.C3H8/c1-5-6(7)3-2-4-8-5;1-3-2/h2-6H,7H2,1H3;3H2,1-2H3/t5-,6?;/m0./s1
InChIKeyXIVOVSNUFWBURA-GNVLWMSISA-N
MW154.26 g/mol
LogP1.76
Rot. Bonds

About (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane

(2S)-2-methyl-2,3-dihydropyridin-3-amine;propane (PubChem CID 143817204) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane.

Molecular Properties

Compound Name(2S)-2-methyl-2,3-dihydropyridin-3-amine;propane
PubChem CID143817204
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name(2S)-2-methyl-2,3-dihydropyridin-3-amine;propane
SMILESCCC.C[C@@H]1N=CC=CC1N
InChIInChI=1S/C6H10N2.C3H8/c1-5-6(7)3-2-4-8-5;1-3-2/h2-6H,7H2,1H3;3H2,1-2H3/t5-,6?;/m0./s1
InChIKeyXIVOVSNUFWBURA-GNVLWMSISA-N
XLogP1.76
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane 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

1-(2-Fluorohex-2-enylideneamino)propan-2-amine
CID 91323823
2,3-Dihydropyridin-3-amine
CID 57288527
2-(2H-pyrrol-1-ium-2-yl)-2H-pyrrol-1-ium
CID 58928041
2,3-Dihydropyridin-2-ylmethanamine
CID 66665484
2-Pentyl-2,3-dihydropyridin-3-amine
CID 67896766
Isobutylidene-2-aminomethylpyridine
CID 70543438
(3-butylidene-2H-pyridin-2-yl)methanamine
CID 70596862
N-methyl-2,3-dihydropyridin-3-amine
CID 70630719
2-Methyl-2,3-dihydropyridin-3-amine
CID 89039076
3-Amino-3-methylpyridine
CID 89174215
3-(Hept-2-enylideneamino)propan-1-amine
CID 123193439
(Z)-5-[(Z)-but-2-enyl]imino-N-methylpent-3-en-2-amine
CID 129043125

Frequently Asked Questions

What is the IUPAC name of (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane?
The IUPAC name of (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane (CID 143817204) is (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane.
What is the SMILES notation for (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane?
The canonical SMILES for (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane is CCC.C[C@@H]1N=CC=CC1N.
What is the InChIKey of (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane?
The InChIKey is XIVOVSNUFWBURA-GNVLWMSISA-N. The full InChI is InChI=1S/C6H10N2.C3H8/c1-5-6(7)3-2-4-8-5;1-3-2/h2-6H,7H2,1H3;3H2,1-2H3/t5-,6?;/m0./s1.
What are the key properties of (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane?
(2S)-2-methyl-2,3-dihydropyridin-3-amine;propane has a molecular weight of 154.26 g/mol, XLogP of 1.76, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-methyl-2,3-dihydropyridin-3-amine;propane is sourced from PubChem (CID 143817204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).