2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide

C14H29N3O — CID 62007585

IUPAC2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide
SMILESCCN(CC(=O)NC1CCCC1)C(C)(CC)CN
InChIInChI=1S/C14H29N3O/c1-4-14(3,11-15)17(5-2)10-13(18)16-12-8-6-7-9-12/h12H,4-11,15H2,1-3H3,(H,16,18)
InChIKeyIMCXWKQDSJNLNH-UHFFFAOYSA-N
MW255.41 g/mol
LogP1.49
Rot. Bonds7

About 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide

2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide (PubChem CID 62007585) has the molecular formula C14H29N3O and a molecular weight of 255.41 g/mol. Its IUPAC name is 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide.

Molecular Properties

Compound Name2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide
PubChem CID62007585
Molecular FormulaC14H29N3O
Molecular Weight255.41 g/mol
Exact Mass255.23
IUPAC Name2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide
SMILESCCN(CC(=O)NC1CCCC1)C(C)(CC)CN
InChIInChI=1S/C14H29N3O/c1-4-14(3,11-15)17(5-2)10-13(18)16-12-8-6-7-9-12/h12H,4-11,15H2,1-3H3,(H,16,18)
InChIKeyIMCXWKQDSJNLNH-UHFFFAOYSA-N
XLogP1.49
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.41
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(1-amino-2-methylbutan-2-yl)-methylamino]-N-cycloheptylacetamide
CID 62548949
2-[(1-amino-2-methylbutan-2-yl)-methylamino]-N-cyclopropylacetamide
CID 62010381
2-[3-(aminomethyl)pentan-3-yl-propylamino]-N-cyclohexylacetamide
CID 62010007
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cyclohexylacetamide
CID 79651871
2-[(3-amino-2,2-dimethylpropyl)-methylamino]-N-cycloheptylacetamide;hydrochloride
CID 119928901
2-[(3-amino-2,2-dimethylpropyl)-propylamino]-N-cycloheptylacetamide
CID 79665477
2-[2-aminoethyl(ethyl)amino]-N-cyclopropylacetamide
CID 61349324
2-(1-amino-2-methylpropan-2-yl)oxy-N-cyclopentylacetamide
CID 65053009
2-[[1-(aminomethyl)cyclopentyl]-ethylamino]-N-cyclohexylacetamide
CID 62007948
2-[3-(aminomethyl)pentan-3-yloxy]-N-cycloheptylacetamide
CID 65050753
2-[2-aminoethyl(cyclobutyl)amino]-N-cycloheptylacetamide
CID 102875096
N-cycloheptyl-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 60685926

Frequently Asked Questions

What is the IUPAC name of 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide?
The IUPAC name of 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide (CID 62007585) is 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide.
What is the SMILES notation for 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide?
The canonical SMILES for 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide is CCN(CC(=O)NC1CCCC1)C(C)(CC)CN.
What is the InChIKey of 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide?
The InChIKey is IMCXWKQDSJNLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O/c1-4-14(3,11-15)17(5-2)10-13(18)16-12-8-6-7-9-12/h12H,4-11,15H2,1-3H3,(H,16,18).
What are the key properties of 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide?
2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide has a molecular weight of 255.41 g/mol, XLogP of 1.49, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1-amino-2-methylbutan-2-yl)-ethylamino]-N-cyclopentylacetamide is sourced from PubChem (CID 62007585), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).