3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine

C8H13N3 — CID 130738864

IUPAC3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine
SMILESCNc1ncccc1[C@H](C)N
InChIInChI=1S/C8H13N3/c1-6(9)7-4-3-5-11-8(7)10-2/h3-6H,9H2,1-2H3,(H,10,11)/t6-/m0/s1
InChIKeyMUKUZSLQTIYWDR-LURJTMIESA-N
MW151.21 g/mol
LogP1.14
Rot. Bonds2

About 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine

3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine (PubChem CID 130738864) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine.

Molecular Properties

Compound Name3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine
PubChem CID130738864
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine
SMILESCNc1ncccc1[C@H](C)N
InChIInChI=1S/C8H13N3/c1-6(9)7-4-3-5-11-8(7)10-2/h3-6H,9H2,1-2H3,(H,10,11)/t6-/m0/s1
InChIKeyMUKUZSLQTIYWDR-LURJTMIESA-N
XLogP1.14
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(1S)-1-(2-methyl-3-pyridinyl)ethanamine
CID 94864826
1-[3-(1-aminoethyl)-2-pyridinyl]ethanol
CID 123838969
1-[2-(trifluoromethyl)-3-pyridinyl]ethanamine
CID 55272660
[3-[(1S)-1-aminoethyl]-2-pyridinyl]methanol
CID 130671700
1-(2-ethynyl-3-pyridinyl)ethanamine
CID 74788747
(1R)-1-quinolin-5-ylethanamine
CID 55277010
(1S,2S)-1-(2-amino-3-pyridinyl)propane-1,2-diamine
CID 131122997
1-(2-piperidin-1-yl-3-pyridinyl)ethanamine
CID 103846595
(1S)-1-(2-phenylsulfanyl-3-pyridinyl)ethanamine
CID 103695131
N-methyl-3-(2-methylpropylsulfanyl)pyridin-2-amine;hydrochloride
CID 175185543
N-methyl-3-(propan-2-ylsulfanylmethyl)pyridin-2-amine
CID 62467144
N-methylmethanamine;1-pyridin-2-ylethanamine
CID 143812006

Frequently Asked Questions

What is the IUPAC name of 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine?
The IUPAC name of 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine (CID 130738864) is 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine.
What is the SMILES notation for 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine?
The canonical SMILES for 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine is CNc1ncccc1[C@H](C)N.
What is the InChIKey of 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine?
The InChIKey is MUKUZSLQTIYWDR-LURJTMIESA-N. The full InChI is InChI=1S/C8H13N3/c1-6(9)7-4-3-5-11-8(7)10-2/h3-6H,9H2,1-2H3,(H,10,11)/t6-/m0/s1.
What are the key properties of 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine?
3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine has a molecular weight of 151.21 g/mol, XLogP of 1.14, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(1S)-1-aminoethyl]-N-methylpyridin-2-amine is sourced from PubChem (CID 130738864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).