2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide

C16H33N3O2 — CID 79565645

IUPAC2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
SMILESCOCC(C)N(C)CCC1CCCC1(NC(C)C)C(N)=O
InChIInChI=1S/C16H33N3O2/c1-12(2)18-16(15(17)20)9-6-7-14(16)8-10-19(4)13(3)11-21-5/h12-14,18H,6-11H2,1-5H3,(H2,17,20)
InChIKeyJECYPLRARLDAGD-UHFFFAOYSA-N
MW299.46 g/mol
LogP1.37
Rot. Bonds9

About 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide

2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide (PubChem CID 79565645) has the molecular formula C16H33N3O2 and a molecular weight of 299.46 g/mol. Its IUPAC name is 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
PubChem CID79565645
Molecular FormulaC16H33N3O2
Molecular Weight299.46 g/mol
Exact Mass299.26
IUPAC Name2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
SMILESCOCC(C)N(C)CCC1CCCC1(NC(C)C)C(N)=O
InChIInChI=1S/C16H33N3O2/c1-12(2)18-16(15(17)20)9-6-7-14(16)8-10-19(4)13(3)11-21-5/h12-14,18H,6-11H2,1-5H3,(H2,17,20)
InChIKeyJECYPLRARLDAGD-UHFFFAOYSA-N
XLogP1.37
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.46
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[2-[methyl(propan-2-yl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79577892
2-[2-[2-ethoxyethyl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 81044055
2-[2-[methyl(propan-2-yl)amino]ethyl]-1-(propylamino)cyclopentane-1-carboxamide
CID 79577899
1-(propan-2-ylamino)-2-[2-(2,2,2-trifluoroethoxy)ethyl]cyclopentane-1-carboxamide
CID 79581093
2-[2-[methyl(3-methylbutan-2-yl)amino]ethyl]-1-(propylamino)cyclopentane-1-carboxamide
CID 79566294
1-(propan-2-ylamino)-2-(2-pyrrolidin-1-ylethyl)cyclopentane-1-carboxamide
CID 79575874
methyl 1-(ethylamino)-2-[2-[methyl(propan-2-yl)amino]ethyl]cyclopentane-1-carboxylate
CID 79577741
2-(2-piperidin-1-ylethyl)-1-(propan-2-ylamino)cyclopentane-1-carboxamide
CID 79578077
2-[2-[cyclopropyl(2-methoxyethyl)amino]ethyl]-1-(ethylamino)cyclopentane-1-carboxamide
CID 79564755
1-(cyclopropylamino)-2-[2-[ethyl(2-methoxyethyl)amino]ethyl]cyclopentane-1-carboxamide
CID 79565485
2-[2-(2-methoxyethoxy)ethyl]-1-(propylamino)cyclopentane-1-carboxamide
CID 79581463
[2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propylamino)cyclopentyl]methanol
CID 79570962

Frequently Asked Questions

What is the IUPAC name of 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
The IUPAC name of 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide (CID 79565645) is 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide is COCC(C)N(C)CCC1CCCC1(NC(C)C)C(N)=O.
What is the InChIKey of 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
The InChIKey is JECYPLRARLDAGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N3O2/c1-12(2)18-16(15(17)20)9-6-7-14(16)8-10-19(4)13(3)11-21-5/h12-14,18H,6-11H2,1-5H3,(H2,17,20).
What are the key properties of 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide?
2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide has a molecular weight of 299.46 g/mol, XLogP of 1.37, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[1-methoxypropan-2-yl(methyl)amino]ethyl]-1-(propan-2-ylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 79565645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).