1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile

C14H25N3O — CID 79565471

IUPAC1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile
SMILESCN(CCC1CCCC1(N)C#N)CC1CCCO1
InChIInChI=1S/C14H25N3O/c1-17(10-13-5-3-9-18-13)8-6-12-4-2-7-14(12,16)11-15/h12-13H,2-10,16H2,1H3
InChIKeyWVNOZUYRBYVVGH-UHFFFAOYSA-N
MW251.37 g/mol
LogP1.51
Rot. Bonds5

About 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile

1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile (PubChem CID 79565471) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile.

Molecular Properties

Compound Name1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile
PubChem CID79565471
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile
SMILESCN(CCC1CCCC1(N)C#N)CC1CCCO1
InChIInChI=1S/C14H25N3O/c1-17(10-13-5-3-9-18-13)8-6-12-4-2-7-14(12,16)11-15/h12-13H,2-10,16H2,1H3
InChIKeyWVNOZUYRBYVVGH-UHFFFAOYSA-N
XLogP1.51
TPSA62.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-amino-2-[2-[methyl-[(2-methylcyclopropyl)methyl]amino]ethyl]cyclopentane-1-carbonitrile
CID 79572666
1-(aminomethyl)-2-[2-[methyl(oxan-2-ylmethyl)amino]ethyl]cyclopentan-1-ol
CID 79587854
1-amino-2-[2-(oxan-2-ylmethoxy)ethyl]cyclopentane-1-carbonitrile
CID 79572364
1-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentan-1-amine
CID 64679700
1-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclobutan-1-amine
CID 79844694
1-amino-2-[2-[butan-2-yl(ethyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79565823
3-[methyl(oxan-2-ylmethyl)amino]propanenitrile
CID 43403608
1-[[methyl(oxolan-2-ylmethyl)amino]methyl]cyclopropan-1-amine
CID 65458658
1-amino-2-[2-[2-(dimethylamino)ethyl-propylamino]ethyl]cyclopentane-1-carbonitrile
CID 79573307
1-amino-2-[2-[1-cyclopropylethyl(methyl)amino]ethyl]cyclopentane-1-carbonitrile
CID 79566124
1-(methylamino)-2-[2-[methyl(oxan-2-ylmethyl)amino]ethyl]cyclopentane-1-carboxamide
CID 79565147
2-chloro-N-methyl-N-(oxolan-2-ylmethyl)ethanamine
CID 61436036

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile?
The IUPAC name of 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile (CID 79565471) is 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile.
What is the SMILES notation for 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile?
The canonical SMILES for 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile is CN(CCC1CCCC1(N)C#N)CC1CCCO1.
What is the InChIKey of 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile?
The InChIKey is WVNOZUYRBYVVGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-17(10-13-5-3-9-18-13)8-6-12-4-2-7-14(12,16)11-15/h12-13H,2-10,16H2,1H3.
What are the key properties of 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile?
1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile has a molecular weight of 251.37 g/mol, XLogP of 1.51, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-[2-[methyl(oxolan-2-ylmethyl)amino]ethyl]cyclopentane-1-carbonitrile is sourced from PubChem (CID 79565471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).