(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine

C11H16N2 — CID 55293023

IUPAC(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine
SMILESCc1cccnc1[C@@H](N)CC1CC1
InChIInChI=1S/C11H16N2/c1-8-3-2-6-13-11(8)10(12)7-9-4-5-9/h2-3,6,9-10H,4-5,7,12H2,1H3/t10-/m0/s1
InChIKeyHPYDTSGECDUXNV-JTQLQIEISA-N
MW176.26 g/mol
LogP2.19
Rot. Bonds3

About (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine

(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine (PubChem CID 55293023) has the molecular formula C11H16N2 and a molecular weight of 176.26 g/mol. Its IUPAC name is (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine.

Molecular Properties

Compound Name(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine
PubChem CID55293023
Molecular FormulaC11H16N2
Molecular Weight176.26 g/mol
Exact Mass176.13
IUPAC Name(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine
SMILESCc1cccnc1[C@@H](N)CC1CC1
InChIInChI=1S/C11H16N2/c1-8-3-2-6-13-11(8)10(12)7-9-4-5-9/h2-3,6,9-10H,4-5,7,12H2,1H3/t10-/m0/s1
InChIKeyHPYDTSGECDUXNV-JTQLQIEISA-N
XLogP2.19
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanol
CID 64904867
(1R)-1-(3-methyl-2-pyridinyl)ethane-1,2-diamine
CID 55264530
2-amino-2-(3-methyl-2-pyridinyl)ethanethiol
CID 88739390
2-amino-2-(3-methyl-2-pyridinyl)ethanol
CID 55293811
1-(3-methoxy-2-pyridinyl)-2-(thian-4-yl)ethanamine
CID 114054414
(1S)-2-methoxy-1-(3-methyl-2-pyridinyl)ethanamine
CID 55293686
(1S)-3,3,3-trifluoro-1-(3-methyl-2-pyridinyl)propan-1-amine
CID 130713891
(1R)-1-(2-bromo-3-pyridinyl)-2-cyclopropylethanamine
CID 130699495
2-cyclopropyl-1-(2-methoxy-3-pyridinyl)ethanamine
CID 55297501
N-[(4-ethylcyclohexyl)-(3-methyl-2-pyridinyl)methyl]ethanamine
CID 64776463
1-(3-methyl-2-pyridinyl)ethanamine;dihydrochloride
CID 127264674
N-[2-cyclopentyl-1-(3-methyl-2-pyridinyl)ethyl]propan-1-amine
CID 62604509

Frequently Asked Questions

What is the IUPAC name of (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine?
The IUPAC name of (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine (CID 55293023) is (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine.
What is the SMILES notation for (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine?
The canonical SMILES for (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine is Cc1cccnc1[C@@H](N)CC1CC1.
What is the InChIKey of (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine?
The InChIKey is HPYDTSGECDUXNV-JTQLQIEISA-N. The full InChI is InChI=1S/C11H16N2/c1-8-3-2-6-13-11(8)10(12)7-9-4-5-9/h2-3,6,9-10H,4-5,7,12H2,1H3/t10-/m0/s1.
What are the key properties of (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine?
(1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine has a molecular weight of 176.26 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1S)-2-cyclopropyl-1-(3-methyl-2-pyridinyl)ethanamine is sourced from PubChem (CID 55293023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).