1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine

C11H22N2 — CID 65457048

IUPAC1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine
SMILESCC1CCCN(CC2(N)CC2)C1C
InChIInChI=1S/C11H22N2/c1-9-4-3-7-13(10(9)2)8-11(12)5-6-11/h9-10H,3-8,12H2,1-2H3
InChIKeyKRUKLFJQPPDQTE-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.60
Rot. Bonds2

About 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine

1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine (PubChem CID 65457048) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine
PubChem CID65457048
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine
SMILESCC1CCCN(CC2(N)CC2)C1C
InChIInChI=1S/C11H22N2/c1-9-4-3-7-13(10(9)2)8-11(12)5-6-11/h9-10H,3-8,12H2,1-2H3
InChIKeyKRUKLFJQPPDQTE-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(2-methylpiperidin-1-yl)methyl]cyclopropan-1-amine
CID 65457487
1-[(2-methylpyrrolidin-1-yl)methyl]cyclopentan-1-amine
CID 60973694
1-[(2-cyclopentylpyrrolidin-1-yl)methyl]cyclopropan-1-amine
CID 65459564
1-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-ylmethyl)cyclopropan-1-amine
CID 65459333
1-[1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclohexyl]-N-methylmethanamine
CID 62257745
1-[(2,4-dimethylpiperidin-1-yl)methyl]cyclobutan-1-amine
CID 81170259
1-[4-[(2,3-dimethylpiperidin-1-yl)methyl]oxan-4-yl]-N-methylmethanamine
CID 62392017
5-[(2,3-dimethylpiperidin-1-yl)methyl]-2,2-dimethylcyclopentan-1-amine
CID 79866962
3-(2,3-dimethylpiperidin-1-yl)-2,2-dimethylpropan-1-amine
CID 62256698
4-(2,3-dimethylpiperidin-1-yl)but-2-en-1-amine
CID 77110314
(2R,3S)-2,3-dimethyl-1-(2,2,2-trifluoroethyl)piperidine
CID 152872015
1-[(4-methylazepan-1-yl)methyl]cyclohexan-1-amine
CID 63625982

Frequently Asked Questions

What is the IUPAC name of 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine?
The IUPAC name of 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine (CID 65457048) is 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine?
The canonical SMILES for 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine is CC1CCCN(CC2(N)CC2)C1C.
What is the InChIKey of 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine?
The InChIKey is KRUKLFJQPPDQTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9-4-3-7-13(10(9)2)8-11(12)5-6-11/h9-10H,3-8,12H2,1-2H3.
What are the key properties of 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine?
1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2,3-dimethylpiperidin-1-yl)methyl]cyclopropan-1-amine is sourced from PubChem (CID 65457048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).