1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile

C14H27N3 — CID 79565336

IUPAC1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile
SMILESCCN(CCC1CCCC1(N)C#N)CC(C)C
InChIInChI=1S/C14H27N3/c1-4-17(10-12(2)3)9-7-13-6-5-8-14(13,16)11-15/h12-13H,4-10,16H2,1-3H3
InChIKeyKBJUBQIZIGTTPP-UHFFFAOYSA-N
MW237.39 g/mol
LogP2.38
Rot. Bonds6

About 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile

1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile (PubChem CID 79565336) has the molecular formula C14H27N3 and a molecular weight of 237.39 g/mol. Its IUPAC name is 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile
PubChem CID79565336
Molecular FormulaC14H27N3
Molecular Weight237.39 g/mol
Exact Mass237.22
IUPAC Name1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile
SMILESCCN(CCC1CCCC1(N)C#N)CC(C)C
InChIInChI=1S/C14H27N3/c1-4-17(10-12(2)3)9-7-13-6-5-8-14(13,16)11-15/h12-13H,4-10,16H2,1-3H3
InChIKeyKBJUBQIZIGTTPP-UHFFFAOYSA-N
XLogP2.38
TPSA53.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.39
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile
CID 79573307
1-amino-2-[2-[butan-2-yl(ethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79565823
1-amino-2-[2-[1-cyclopropylethyl(methyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79566124
1-amino-2-[2-(4-methylpentoxy)ethyl]cyclopentane-1-carbonitrile
CID 79572031
[2-[2-[ethyl(2-methylpropyl)amino]ethyl]-1-(methylamino)cyclopentyl]methanol
CID 79571940
1-amino-2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]cyclopentane-1-carbonitrile
CID 79572666
1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79565471
1-amino-2-[2-[ethyl(2-methylbutyl)amino]ethyl]cyclopentane-1-carboxamide
CID 79571261
1-amino-2-[2-(2-methylpentoxy)ethyl]cyclopentane-1-carbonitrile
CID 103284836
1-amino-2-(2-cyclopentyloxyethyl)cyclopentane-1-carbonitrile
CID 79572377
1-amino-2-[2-(1,1,1-trifluoropropan-2-yloxy)ethyl]cyclopentane-1-carbonitrile
CID 79575827
1-amino-2-[2-(2-ethylcyclohexyl)oxyethyl]cyclopentane-1-carbonitrile
CID 79573395

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile?
The IUPAC name of 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile (CID 79565336) is 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile?
The canonical SMILES for 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile is CCN(CCC1CCCC1(N)C#N)CC(C)C.
What is the InChIKey of 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile?
The InChIKey is KBJUBQIZIGTTPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N3/c1-4-17(10-12(2)3)9-7-13-6-5-8-14(13,16)11-15/h12-13H,4-10,16H2,1-3H3.
What are the key properties of 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile?
1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile has a molecular weight of 237.39 g/mol, XLogP of 2.38, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[2-[ethyl(2-methylpropyl)amino]ethyl]cyclopentane-1-carbonitrile is sourced from PubChem (CID 79565336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).