1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile

C10H16N2 — CID 164649621

IUPAC1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile
SMILESCN(CC1CCC1)C1(C#N)CC1
InChIInChI=1S/C10H16N2/c1-12(7-9-3-2-4-9)10(8-11)5-6-10/h9H,2-7H2,1H3
InChIKeyFVJPKNGIIYLHTG-UHFFFAOYSA-N
MW164.25 g/mol
LogP1.77
Rot. Bonds3

About 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile

1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile (PubChem CID 164649621) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile.

Molecular Properties

Compound Name1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile
PubChem CID164649621
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile
SMILESCN(CC1CCC1)C1(C#N)CC1
InChIInChI=1S/C10H16N2/c1-12(7-9-3-2-4-9)10(8-11)5-6-10/h9H,2-7H2,1H3
InChIKeyFVJPKNGIIYLHTG-UHFFFAOYSA-N
XLogP1.77
TPSA27.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-cyano-N-(cyclobutylmethyl)-N-methylcyclopentane-1-carboxamide
CID 62862227
1-[[cyclopentylmethyl(methyl)amino]methyl]cyclopropane-1-carbonitrile
CID 115242434
1-cyano-N-(cyclobutylmethyl)-N-methylcyclohexane-1-carboxamide
CID 62862228
2-[cyclohexylmethyl(methyl)amino]acetonitrile
CID 60750592
1-cyclobutyl-N,N-dimethylmethanamine
CID 4285302
4-cyano-N-(cyclobutylmethyl)-N-methyloxane-4-carboxamide
CID 55126193
1-(aminomethyl)-N-(cyclobutylmethyl)-N,2,2-trimethylcyclopentan-1-amine
CID 79857351
1-(diethylamino)-4-ethylcycloheptane-1-carbonitrile
CID 65085850
2-[2-[cyclobutylmethyl(methyl)amino]ethyl]-1-(cyclopropylamino)cyclopentane-1-carbonitrile
CID 79573800
3-[cyclohexylmethyl(methyl)amino]-1-(cyclopropylamino)cyclohexane-1-carbonitrile
CID 79626858
1-(dimethylamino)-4-propylcyclohexane-1-carbonitrile
CID 60917267
1-(aminomethyl)-N-(cyclohexylmethyl)-N-methylcyclobutan-1-amine
CID 79521344

Frequently Asked Questions

What is the IUPAC name of 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile?
The IUPAC name of 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile (CID 164649621) is 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile.
What is the SMILES notation for 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile?
The canonical SMILES for 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile is CN(CC1CCC1)C1(C#N)CC1.
What is the InChIKey of 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile?
The InChIKey is FVJPKNGIIYLHTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-12(7-9-3-2-4-9)10(8-11)5-6-10/h9H,2-7H2,1H3.
What are the key properties of 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile?
1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile has a molecular weight of 164.25 g/mol, XLogP of 1.77, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[cyclobutylmethyl(methyl)amino]cyclopropane-1-carbonitrile is sourced from PubChem (CID 164649621), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).