N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine

C13H20N2 — CID 81018367

IUPACN-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
SMILESCC(C)NCC1CCC1c1cccnc1
InChIInChI=1S/C13H20N2/c1-10(2)15-9-12-5-6-13(12)11-4-3-7-14-8-11/h3-4,7-8,10,12-13,15H,5-6,9H2,1-2H3
InChIKeyGKMIEZJCZSTALY-UHFFFAOYSA-N
MW204.32 g/mol
LogP2.57
Rot. Bonds4

About N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine

N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine (PubChem CID 81018367) has the molecular formula C13H20N2 and a molecular weight of 204.32 g/mol. Its IUPAC name is N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine.

Molecular Properties

Compound NameN-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
PubChem CID81018367
Molecular FormulaC13H20N2
Molecular Weight204.32 g/mol
Exact Mass204.16
IUPAC NameN-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine
SMILESCC(C)NCC1CCC1c1cccnc1
InChIInChI=1S/C13H20N2/c1-10(2)15-9-12-5-6-13(12)11-4-3-7-14-8-11/h3-4,7-8,10,12-13,15H,5-6,9H2,1-2H3
InChIKeyGKMIEZJCZSTALY-UHFFFAOYSA-N
XLogP2.57
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.32
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2-pyridin-3-ylcyclohexyl)methyl]propan-2-amine
CID 81027798
N-[(4-propan-2-yl-2-pyridin-3-ylcyclohexyl)methyl]propan-1-amine
CID 81029849
N-[[2-(3,5-difluorophenyl)cyclobutyl]methyl]propan-2-amine
CID 81018163
[(1S,2S)-2-pyridin-3-ylcyclopentyl]methanamine
CID 138571732
3-(2-methylcyclobutyl)pyridine
CID 174716389
N-[(2-quinolin-5-ylcyclobutyl)methyl]propan-2-amine
CID 81222405
N-[[2-(5-fluoro-3-pyridinyl)cyclopentyl]methyl]propan-2-amine
CID 81034048
N-[(2-pyrazin-2-ylcyclopentyl)methyl]propan-2-amine
CID 81033718
N-[[2-(1-propylpyrazol-4-yl)cyclobutyl]methyl]propan-2-amine
CID 81017644
N-[[4-propyl-2-(pyridin-3-ylmethyl)cyclohexyl]methyl]propan-2-amine
CID 104737410
N-[(2-pyrazin-2-ylcycloheptyl)methyl]propan-2-amine
CID 81025607
3-[(1S,2R)-2-propan-2-ylcyclopropyl]pyridine
CID 167340168

Frequently Asked Questions

What is the IUPAC name of N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
The IUPAC name of N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine (CID 81018367) is N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine.
What is the SMILES notation for N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
The canonical SMILES for N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine is CC(C)NCC1CCC1c1cccnc1.
What is the InChIKey of N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
The InChIKey is GKMIEZJCZSTALY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2/c1-10(2)15-9-12-5-6-13(12)11-4-3-7-14-8-11/h3-4,7-8,10,12-13,15H,5-6,9H2,1-2H3.
What are the key properties of N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine?
N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine has a molecular weight of 204.32 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-pyridin-3-ylcyclobutyl)methyl]propan-2-amine is sourced from PubChem (CID 81018367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).