1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine

C11H22N2 — CID 62860068

IUPAC1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
SMILESCN(CC1CCC1)CC1CCNC1
InChIInChI=1S/C11H22N2/c1-13(8-10-3-2-4-10)9-11-5-6-12-7-11/h10-12H,2-9H2,1H3
InChIKeyFWNCHZRAKVLHJJ-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.33
Rot. Bonds4

About 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine

1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine (PubChem CID 62860068) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine.

Molecular Properties

Compound Name1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
PubChem CID62860068
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine
SMILESCN(CC1CCC1)CC1CCNC1
InChIInChI=1S/C11H22N2/c1-13(8-10-3-2-4-10)9-11-5-6-12-7-11/h10-12H,2-9H2,1H3
InChIKeyFWNCHZRAKVLHJJ-UHFFFAOYSA-N
XLogP1.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)methanamine;hydrochloride
CID 119930005
N-methyl-N-(pyrrolidin-3-ylmethyl)propan-1-amine
CID 54596082
2-cyclobutyl-N-methyl-N-(2-pyrrolidin-3-ylethyl)ethanamine
CID 115210939
N,N-dimethyl-1-pyrrolidin-3-ylmethanamine;dihydrochloride
CID 23145859
(Z)-N-methyl-N-(pyrrolidin-3-ylmethyl)but-2-en-1-amine
CID 143248520
N-(cyclobutylmethyl)-N-methyl-3-piperidin-3-ylpropan-1-amine
CID 62861568
2-methoxy-N-methyl-N-(pyrrolidin-3-ylmethyl)ethanamine
CID 62371781
N-methyl-N-(oxolan-3-ylmethyl)-1-piperidin-3-ylmethanamine;hydrochloride
CID 119932323
3,3-difluoro-N-methyl-N-(pyrrolidin-3-ylmethyl)butan-1-amine
CID 84674397
N-methyl-N-(1-oxaspiro[4.4]nonan-2-ylmethyl)-1-piperidin-3-ylmethanamine
CID 106637126
2,2-difluoro-N-methyl-N-(piperidin-3-ylmethyl)propan-1-amine
CID 84674393
N,4-dimethyl-N-(pyrrolidin-3-ylmethyl)pentan-1-amine
CID 115209057

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine?
The IUPAC name of 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine (CID 62860068) is 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine.
What is the SMILES notation for 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine?
The canonical SMILES for 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine is CN(CC1CCC1)CC1CCNC1.
What is the InChIKey of 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine?
The InChIKey is FWNCHZRAKVLHJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-13(8-10-3-2-4-10)9-11-5-6-12-7-11/h10-12H,2-9H2,1H3.
What are the key properties of 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine?
1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine has a molecular weight of 182.31 g/mol, XLogP of 1.33, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-methyl-N-(pyrrolidin-3-ylmethyl)methanamine is sourced from PubChem (CID 62860068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).