N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide

C11H21N3O — CID 62408631

IUPACN-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide
SMILESCC1CC1NC(=O)C(C)N1CCNCC1
InChIInChI=1S/C11H21N3O/c1-8-7-10(8)13-11(15)9(2)14-5-3-12-4-6-14/h8-10,12H,3-7H2,1-2H3,(H,13,15)
InChIKeyKERKJCMOSHRKMI-UHFFFAOYSA-N
MW211.31 g/mol
LogP-0.20
Rot. Bonds3

About N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide

N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide (PubChem CID 62408631) has the molecular formula C11H21N3O and a molecular weight of 211.31 g/mol. Its IUPAC name is N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide.

Molecular Properties

Compound NameN-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide
PubChem CID62408631
Molecular FormulaC11H21N3O
Molecular Weight211.31 g/mol
Exact Mass211.17
IUPAC NameN-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide
SMILESCC1CC1NC(=O)C(C)N1CCNCC1
InChIInChI=1S/C11H21N3O/c1-8-7-10(8)13-11(15)9(2)14-5-3-12-4-6-14/h8-10,12H,3-7H2,1-2H3,(H,13,15)
InChIKeyKERKJCMOSHRKMI-UHFFFAOYSA-N
XLogP-0.20
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-0.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-2-(1,4-diazepan-1-yl)propanamide
CID 43115733
N-(1-methylpiperidin-4-yl)-2-piperazin-1-ylpropanamide
CID 43373704
N-cyclopropyl-2-(1,4-diazepan-1-yl)propanamide;hydrochloride
CID 119925326
N-cyclopentyl-2-(1,4-diazepan-1-yl)propanamide
CID 43115745
2-(azepan-1-yl)-N-(3-methylpiperidin-4-yl)propanamide;dihydrochloride
CID 120557148
N-(3-ethylcyclohexyl)-2-piperazin-1-ylpropanamide
CID 64743330
N-(1,1-dioxothian-3-yl)-2-piperazin-1-ylpropanamide
CID 63924147
1-(3,5-dimethylpiperidin-1-yl)-2-piperazin-1-ylpropan-1-one
CID 43130716
N-(4-fluorophenyl)-2-piperazin-1-ylpropanamide
CID 43089583
N-(2,2-difluoroethyl)-2-piperazin-1-ylpropanamide
CID 115407717
2-(azepan-1-yl)-N-pyrrolidin-3-ylpropanamide
CID 119450526
methyl 2-(2-piperazin-1-ylpropanoylamino)propanoate
CID 54960724

Frequently Asked Questions

What is the IUPAC name of N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide?
The IUPAC name of N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide (CID 62408631) is N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide.
What is the SMILES notation for N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide?
The canonical SMILES for N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide is CC1CC1NC(=O)C(C)N1CCNCC1.
What is the InChIKey of N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide?
The InChIKey is KERKJCMOSHRKMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21N3O/c1-8-7-10(8)13-11(15)9(2)14-5-3-12-4-6-14/h8-10,12H,3-7H2,1-2H3,(H,13,15).
What are the key properties of N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide?
N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide has a molecular weight of 211.31 g/mol, XLogP of -0.20, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylcyclopropyl)-2-piperazin-1-ylpropanamide is sourced from PubChem (CID 62408631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).