N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide

C12H19NO — CID 15304135

IUPACN,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide
SMILESCC(C)N(C(=O)C1C=CC=C1)C(C)C
InChIInChI=1S/C12H19NO/c1-9(2)13(10(3)4)12(14)11-7-5-6-8-11/h5-11H,1-4H3
InChIKeyNFCWBQHTNNDKQT-UHFFFAOYSA-N
MW193.29 g/mol
LogP2.37
Rot. Bonds3

About N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide

N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide (PubChem CID 15304135) has the molecular formula C12H19NO and a molecular weight of 193.29 g/mol. Its IUPAC name is N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide.

Molecular Properties

Compound NameN,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide
PubChem CID15304135
Molecular FormulaC12H19NO
Molecular Weight193.29 g/mol
Exact Mass193.15
IUPAC NameN,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide
SMILESCC(C)N(C(=O)C1C=CC=C1)C(C)C
InChIInChI=1S/C12H19NO/c1-9(2)13(10(3)4)12(14)11-7-5-6-8-11/h5-11H,1-4H3
InChIKeyNFCWBQHTNNDKQT-UHFFFAOYSA-N
XLogP2.37
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze N,N-di(propan-2-yl)cyclopenta-2,4-diene-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

1-Ethyl-3,5,7-trimethyl-1,3-dihydro-2H-azepin-2-one
CID 282185
(3E)-N,N-Diethyl-3-pentenamide
CID 5369259
(3E,6E)-N,N-diethylocta-3,6-dienamide
CID 10262074
Butdwkjfxqffov-uhfffaoysa-
CID 12590284
3-Pentenamide, N,N-diethyl-
CID 567780
1,6-dimethyl-3,6-dihydro-2H-azepin-7-one
CID 18725829
N-[(2Z,6Z)-nona-2,6-dienyl]-N-propan-2-ylpropanamide
CID 57711028
N-[(2E,6Z)-nona-2,6-dienyl]-N-propan-2-ylpropanamide
CID 57711134
1-(2,5-Dimethyl-2,5-dihydropyrrol-1-yl)butan-1-one
CID 68152709
N-nona-2,6-dienyl-N-propan-2-ylpropanamide
CID 76600094
1,2,5-Trimethyl-2,5-dihydropyridin-6-one
CID 89190198
1,5-di(propan-2-yl)-3H-pyrrol-2-one
CID 89447263

Frequently Asked Questions

What is the IUPAC name of N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide?
The IUPAC name of N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide (CID 15304135) is N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide.
What is the SMILES notation for N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide?
The canonical SMILES for N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide is CC(C)N(C(=O)C1C=CC=C1)C(C)C.
What is the InChIKey of N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide?
The InChIKey is NFCWBQHTNNDKQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO/c1-9(2)13(10(3)4)12(14)11-7-5-6-8-11/h5-11H,1-4H3.
What are the key properties of N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide?
N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide has a molecular weight of 193.29 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di(propan-2-yl)cyclopenta-2,4-diene-1-carboxamide is sourced from PubChem (CID 15304135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).