3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide

C15H26N4O — CID 145040181

IUPAC3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide
SMILESCC(C)N1C[C@H](C)[C@H](NC(=O)C2=CN(C3CC3)CN2)C1
InChIInChI=1S/C15H26N4O/c1-10(2)18-6-11(3)13(7-18)17-15(20)14-8-19(9-16-14)12-4-5-12/h8,10-13,16H,4-7,9H2,1-3H3,(H,17,20)/t11-,13+/m0/s1
InChIKeyNYPBJSMCSKDTIM-WCQYABFASA-N
MW278.40 g/mol
LogP0.70
Rot. Bonds4

About 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide

3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide (PubChem CID 145040181) has the molecular formula C15H26N4O and a molecular weight of 278.40 g/mol. Its IUPAC name is 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide.

Molecular Properties

Compound Name3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide
PubChem CID145040181
Molecular FormulaC15H26N4O
Molecular Weight278.40 g/mol
Exact Mass278.21
IUPAC Name3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide
SMILESCC(C)N1C[C@H](C)[C@H](NC(=O)C2=CN(C3CC3)CN2)C1
InChIInChI=1S/C15H26N4O/c1-10(2)18-6-11(3)13(7-18)17-15(20)14-8-19(9-16-14)12-4-5-12/h8,10-13,16H,4-7,9H2,1-3H3,(H,17,20)/t11-,13+/m0/s1
InChIKeyNYPBJSMCSKDTIM-WCQYABFASA-N
XLogP0.70
TPSA47.61 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 50.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide with MolForge

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Related Compounds

3-methyl-2-oxo-N-[1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]-1H-imidazole-5-carboxamide
CID 138034273
N-[1-(2,2-difluoroethyl)pyrrolidin-3-yl]-3-methyl-2-oxo-1H-imidazole-5-carboxamide
CID 138036109
3-(2-methyl-1-pyrrolidin-1-ylpropan-2-yl)-2-oxo-1H-imidazole-5-carboxamide
CID 69526753
N-(3-azabicyclo[3.1.0]hexan-6-yl)-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 43594249
N-[3-(cyclopropylamino)propyl]-2-oxo-1,3-dihydroimidazole-4-carboxamide
CID 43596296
N-[(1-cycloheptylpyrrolidin-3-yl)methyl]-2-oxo-2,3-dihydro-1H-imidazole-4-carboxamide
CID 56702105
6-Amino-5-[[(1-cyclopropyl-3-pyrrolidinyl)methyl]amino]-1-methyl-2,4(1H,3H)-pyrimidinedione
CID 60759744
4-(3-Aminopyrrolidine-1-carbonyl)-1,3-dihydroimidazol-2-one
CID 62067810
4-[3-(Aminomethyl)pyrrolidine-1-carbonyl]-1,3-dihydroimidazol-2-one
CID 62069433
2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
CID 62378989
4-[3-(Methylaminomethyl)pyrrolidine-1-carbonyl]-1,3-dihydroimidazol-2-one
CID 63263319
N-methyl-2-oxo-N-pyrrolidin-3-yl-1,3-dihydroimidazole-4-carboxamide
CID 63297697

Frequently Asked Questions

What is the IUPAC name of 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide?
The IUPAC name of 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide (CID 145040181) is 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide.
What is the SMILES notation for 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide?
The canonical SMILES for 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide is CC(C)N1C[C@H](C)[C@H](NC(=O)C2=CN(C3CC3)CN2)C1.
What is the InChIKey of 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide?
The InChIKey is NYPBJSMCSKDTIM-WCQYABFASA-N. The full InChI is InChI=1S/C15H26N4O/c1-10(2)18-6-11(3)13(7-18)17-15(20)14-8-19(9-16-14)12-4-5-12/h8,10-13,16H,4-7,9H2,1-3H3,(H,17,20)/t11-,13+/m0/s1.
What are the key properties of 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide?
3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide has a molecular weight of 278.40 g/mol, XLogP of 0.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropyl-N-[(3S,4S)-4-methyl-1-propan-2-ylpyrrolidin-3-yl]-1,2-dihydroimidazole-5-carboxamide is sourced from PubChem (CID 145040181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).