N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide

C19H28N4O2 — CID 119573319

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
SMILESCCCn1c(=O)n(CCC(=O)NC(C)(CN)C2CC2)c2ccccc21
InChIInChI=1S/C19H28N4O2/c1-3-11-22-15-6-4-5-7-16(15)23(18(22)25)12-10-17(24)21-19(2,13-20)14-8-9-14/h4-7,14H,3,8-13,20H2,1-2H3,(H,21,24)
InChIKeyYWDZRLXNSHDRLV-UHFFFAOYSA-N
MW344.46 g/mol
LogP1.85
Rot. Bonds8

About N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide

N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide (PubChem CID 119573319) has the molecular formula C19H28N4O2 and a molecular weight of 344.46 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
PubChem CID119573319
Molecular FormulaC19H28N4O2
Molecular Weight344.46 g/mol
Exact Mass344.22
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
SMILESCCCn1c(=O)n(CCC(=O)NC(C)(CN)C2CC2)c2ccccc21
InChIInChI=1S/C19H28N4O2/c1-3-11-22-15-6-4-5-7-16(15)23(18(22)25)12-10-17(24)21-19(2,13-20)14-8-9-14/h4-7,14H,3,8-13,20H2,1-2H3,(H,21,24)
InChIKeyYWDZRLXNSHDRLV-UHFFFAOYSA-N
XLogP1.85
TPSA82.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N'-[3-(2-oxo-3-propylbenzimidazol-1-yl)propanoyl]cyclopropanecarbohydrazide
CID 27019386
N-(3-aminopropyl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide;hydrochloride
CID 119406011
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(4-oxoquinazolin-3-yl)propanamide
CID 119574378
N-[4-(carbamoylamino)phenyl]-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide
CID 33154220
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide
CID 119574836
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-bromophenyl)propanamide
CID 119575176
N-(1-amino-2-cyclopropylpropan-2-yl)-2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetamide;hydrochloride
CID 119574835
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(4-pyridin-2-ylpiperazin-1-yl)propanamide;dihydrochloride
CID 119572479
1-[3-[4-(methylamino)piperidin-1-yl]-3-oxopropyl]-3-propylbenzimidazol-2-one
CID 119560953
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-bromophenyl)propanamide;hydrochloride
CID 119575175
3-(2-oxo-3-propylbenzimidazol-1-yl)-N-(2-piperidin-3-ylethyl)propanamide
CID 119556281
1-(2-cyclopentyl-2-oxoethyl)-3-propylbenzimidazol-2-one
CID 104751301

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide (CID 119573319) is N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide is CCCn1c(=O)n(CCC(=O)NC(C)(CN)C2CC2)c2ccccc21.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
The InChIKey is YWDZRLXNSHDRLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N4O2/c1-3-11-22-15-6-4-5-7-16(15)23(18(22)25)12-10-17(24)21-19(2,13-20)14-8-9-14/h4-7,14H,3,8-13,20H2,1-2H3,(H,21,24).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide has a molecular weight of 344.46 g/mol, XLogP of 1.85, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-3-(2-oxo-3-propylbenzimidazol-1-yl)propanamide is sourced from PubChem (CID 119573319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).