1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine

C11H22N2 — CID 107399406

IUPAC1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine
SMILESCCN(CC1CCC1)CC1(N)CC1
InChIInChI=1S/C11H22N2/c1-2-13(8-10-4-3-5-10)9-11(12)6-7-11/h10H,2-9,12H2,1H3
InChIKeyNHFISUHMRBHCFF-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.60
Rot. Bonds5

About 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine

1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine (PubChem CID 107399406) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine.

Molecular Properties

Compound Name1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine
PubChem CID107399406
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine
SMILESCCN(CC1CCC1)CC1(N)CC1
InChIInChI=1S/C11H22N2/c1-2-13(8-10-4-3-5-10)9-11(12)6-7-11/h10H,2-9,12H2,1H3
InChIKeyNHFISUHMRBHCFF-UHFFFAOYSA-N
XLogP1.60
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
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-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropyl]methanethiol
CID 107402951
[1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopentyl]methanol
CID 107401743
1-[[cyclopropylmethyl(propyl)amino]methyl]cyclohexan-1-amine
CID 61443301
N-(cyclobutylmethyl)-N-[(4-ethylpiperidin-4-yl)methyl]ethanamine
CID 107399460
N-(cyclobutylmethyl)-N-[(2-methylpyrrolidin-2-yl)methyl]ethanamine
CID 107399295
1-[[cyclopropylmethyl(ethyl)amino]methyl]cyclopentan-1-ol
CID 65212842
N-[[1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclohexyl]methyl]propan-2-amine
CID 107401676
N-[[1-[[cyclobutylmethyl(ethyl)amino]methyl]cycloheptyl]methyl]cyclopropanamine
CID 107401601
[3-[[cyclobutylmethyl(ethyl)amino]methyl]oxolan-3-yl]methanol
CID 107401725
3-(diethylaminomethyl)cyclohexan-1-amine
CID 63045933
N'-(cyclohexylmethyl)-N,N,N'-triethylethane-1,2-diamine
CID 2058149
N-[[1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclohexyl]methyl]-2-methylpropan-1-amine
CID 107401614

Frequently Asked Questions

What is the IUPAC name of 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine?
The IUPAC name of 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine (CID 107399406) is 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine.
What is the SMILES notation for 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine?
The canonical SMILES for 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine is CCN(CC1CCC1)CC1(N)CC1.
What is the InChIKey of 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine?
The InChIKey is NHFISUHMRBHCFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-2-13(8-10-4-3-5-10)9-11(12)6-7-11/h10H,2-9,12H2,1H3.
What are the key properties of 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine?
1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine has a molecular weight of 182.31 g/mol, XLogP of 1.60, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[cyclobutylmethyl(ethyl)amino]methyl]cyclopropan-1-amine is sourced from PubChem (CID 107399406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).