1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile

C15H30N4 — CID 79573307

IUPAC1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile
SMILESCCCN(CCC1CCCC1(N)C#N)CCN(C)C
InChIInChI=1S/C15H30N4/c1-4-9-19(12-11-18(2)3)10-7-14-6-5-8-15(14,17)13-16/h14H,4-12,17H2,1-3H3
InChIKeyCKBOIXBRIWBCDM-UHFFFAOYSA-N
MW266.43 g/mol
LogP1.67
Rot. Bonds8

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

1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile (PubChem CID 79573307) has the molecular formula C15H30N4 and a molecular weight of 266.43 g/mol. Its IUPAC name is 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile
PubChem CID79573307
Molecular FormulaC15H30N4
Molecular Weight266.43 g/mol
Exact Mass266.25
IUPAC Name1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile
SMILESCCCN(CCC1CCCC1(N)C#N)CCN(C)C
InChIInChI=1S/C15H30N4/c1-4-9-19(12-11-18(2)3)10-7-14-6-5-8-15(14,17)13-16/h14H,4-12,17H2,1-3H3
InChIKeyCKBOIXBRIWBCDM-UHFFFAOYSA-N
XLogP1.67
TPSA56.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-Amino-2-[2-[methyl(2,2,2-trifluoroethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79564738
1-Amino-2-[2-[propan-2-yl(2,2,2-trifluoroethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79564743
1-Amino-2-[2-[propyl(2,2,2-trifluoroethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79565658
1-Amino-2-[2-[ethyl(2,2,2-trifluoroethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79565849
1-Amino-2-[2-[methyl(3,3,3-trifluoropropyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79573611
1-Amino-2-[2-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]ethyl]cyclopentane-1-carbonitrile
CID 79575760
1-Amino-2-[2-[2,2-difluoroethyl(methyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 116316921
2-Cyclopentyl-2-[2-(dimethylamino)ethylamino]propanenitrile
CID 62632304
2-Cyclopentyl-2-[2-(diethylamino)ethylamino]propanenitrile
CID 62632305
2-Amino-3-[cyclopentylmethyl(methyl)amino]-2-methylpropanenitrile
CID 63632166
2-Amino-3-[cyclopentylmethyl(methyl)amino]-2-cyclopropylpropanenitrile
CID 63908348
2-Methyl-1-(2-methylpropylamino)cyclopentane-1-carbonitrile
CID 65044961

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile?
The IUPAC name of 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile (CID 79573307) is 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile?
The canonical SMILES for 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile is CCCN(CCC1CCCC1(N)C#N)CCN(C)C.
What is the InChIKey of 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile?
The InChIKey is CKBOIXBRIWBCDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N4/c1-4-9-19(12-11-18(2)3)10-7-14-6-5-8-15(14,17)13-16/h14H,4-12,17H2,1-3H3.
What are the key properties of 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile?
1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile has a molecular weight of 266.43 g/mol, XLogP of 1.67, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile is sourced from PubChem (CID 79573307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).