N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide

C15H29N3O — CID 20778277

IUPACN-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)CC1=NCCN1CCNC(=O)C(C)(C)C
InChIInChI=1S/C15H29N3O/c1-14(2,3)11-12-16-7-9-18(12)10-8-17-13(19)15(4,5)6/h7-11H2,1-6H3,(H,17,19)
InChIKeyQFZGQLKEZMZJEA-UHFFFAOYSA-N
MW267.42 g/mol
LogP2.30
Rot. Bonds4

About N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide

N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide (PubChem CID 20778277) has the molecular formula C15H29N3O and a molecular weight of 267.42 g/mol. Its IUPAC name is N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide.

Molecular Properties

Compound NameN-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide
PubChem CID20778277
Molecular FormulaC15H29N3O
Molecular Weight267.42 g/mol
Exact Mass267.23
IUPAC NameN-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide
SMILESCC(C)(C)CC1=NCCN1CCNC(=O)C(C)(C)C
InChIInChI=1S/C15H29N3O/c1-14(2,3)11-12-16-7-9-18(12)10-8-17-13(19)15(4,5)6/h7-11H2,1-6H3,(H,17,19)
InChIKeyQFZGQLKEZMZJEA-UHFFFAOYSA-N
XLogP2.30
TPSA44.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.42
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide?
The IUPAC name of N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide (CID 20778277) is N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide.
What is the SMILES notation for N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide?
The canonical SMILES for N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide is CC(C)(C)CC1=NCCN1CCNC(=O)C(C)(C)C.
What is the InChIKey of N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide?
The InChIKey is QFZGQLKEZMZJEA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N3O/c1-14(2,3)11-12-16-7-9-18(12)10-8-17-13(19)15(4,5)6/h7-11H2,1-6H3,(H,17,19).
What are the key properties of N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide?
N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide has a molecular weight of 267.42 g/mol, XLogP of 2.30, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(2,2-dimethylpropyl)-4,5-dihydroimidazol-1-yl]ethyl]-2,2-dimethylpropanamide is sourced from PubChem (CID 20778277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).