3-(2H-pyridin-1-yl)propan-1-amine

C8H14N2 — CID 21495195

IUPAC3-(2H-pyridin-1-yl)propan-1-amine
SMILESNCCCN1C=CC=CC1
InChIInChI=1S/C8H14N2/c9-5-4-8-10-6-2-1-3-7-10/h1-3,6H,4-5,7-9H2
InChIKeyVBQPLWMHALIRME-UHFFFAOYSA-N
MW138.21 g/mol
LogP0.72
Rot. Bonds3

About 3-(2H-pyridin-1-yl)propan-1-amine

3-(2H-pyridin-1-yl)propan-1-amine (PubChem CID 21495195) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 3-(2H-pyridin-1-yl)propan-1-amine.

Molecular Properties

Compound Name3-(2H-pyridin-1-yl)propan-1-amine
PubChem CID21495195
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name3-(2H-pyridin-1-yl)propan-1-amine
SMILESNCCCN1C=CC=CC1
InChIInChI=1S/C8H14N2/c9-5-4-8-10-6-2-1-3-7-10/h1-3,6H,4-5,7-9H2
InChIKeyVBQPLWMHALIRME-UHFFFAOYSA-N
XLogP0.72
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-allyl-2-aminopyridine
CID 67696353
3-(4-fluoro-2H-pyridin-1-yl)propan-1-amine
CID 176888984
2-(2H-pyridin-1-yl)ethanamine
CID 18470667
(1-methyl-2H-pyridin-3-yl)methanamine
CID 18939701
1-Ethyl-1,2-dihydropyridin-1-ium
CID 19829251
1-Prop-2-enyl-1,2-dihydropyridin-1-ium
CID 19829268
3-(6-methyl-2H-pyridin-1-yl)propan-1-amine
CID 19899440
5-(2H-pyridin-1-yl)pentan-1-amine
CID 21495181
4-(2H-pyridin-1-yl)butan-1-amine
CID 21495187
6-(2H-pyridin-1-yl)hexan-1-amine
CID 21495193
1-(1,2-dihydropyridin-4-yl)-2H-pyridine
CID 21988749
N-methyl-2-(2H-pyridin-1-yl)ethanamine
CID 22420292

Frequently Asked Questions

What is the IUPAC name of 3-(2H-pyridin-1-yl)propan-1-amine?
The IUPAC name of 3-(2H-pyridin-1-yl)propan-1-amine (CID 21495195) is 3-(2H-pyridin-1-yl)propan-1-amine.
What is the SMILES notation for 3-(2H-pyridin-1-yl)propan-1-amine?
The canonical SMILES for 3-(2H-pyridin-1-yl)propan-1-amine is NCCCN1C=CC=CC1.
What is the InChIKey of 3-(2H-pyridin-1-yl)propan-1-amine?
The InChIKey is VBQPLWMHALIRME-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c9-5-4-8-10-6-2-1-3-7-10/h1-3,6H,4-5,7-9H2.
What are the key properties of 3-(2H-pyridin-1-yl)propan-1-amine?
3-(2H-pyridin-1-yl)propan-1-amine has a molecular weight of 138.21 g/mol, XLogP of 0.72, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2H-pyridin-1-yl)propan-1-amine is sourced from PubChem (CID 21495195), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).