N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide

C11H19N3O2 — CID 116656665

IUPACN-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide
SMILESO=C(CCNC(=O)N1CCCC1)NC1CC1
InChIInChI=1S/C11H19N3O2/c15-10(13-9-3-4-9)5-6-12-11(16)14-7-1-2-8-14/h9H,1-8H2,(H,12,16)(H,13,15)
InChIKeyPDBKHNWZHYILDO-UHFFFAOYSA-N
MW225.29 g/mol
LogP0.46
Rot. Bonds4

About N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide

N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide (PubChem CID 116656665) has the molecular formula C11H19N3O2 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide
PubChem CID116656665
Molecular FormulaC11H19N3O2
Molecular Weight225.29 g/mol
Exact Mass225.15
IUPAC NameN-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide
SMILESO=C(CCNC(=O)N1CCCC1)NC1CC1
InChIInChI=1S/C11H19N3O2/c15-10(13-9-3-4-9)5-6-12-11(16)14-7-1-2-8-14/h9H,1-8H2,(H,12,16)(H,13,15)
InChIKeyPDBKHNWZHYILDO-UHFFFAOYSA-N
XLogP0.46
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 50.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

1-[[3-(cyclopropylamino)-3-oxopropyl]carbamoyl]pyrrolidine-3-carboxylic acid
CID 79400729
1-[[3-(cyclopropylamino)-3-oxopropyl]carbamoyl]piperidine-2-carboxylic acid
CID 79401803
(3S)-1-[[4-(cyclopropylamino)-4-oxobutyl]carbamoyl]piperidine-3-carboxylic acid
CID 81118415
1-[[4-(cyclopropylamino)-4-oxobutyl]carbamoyl]piperidine-3-carboxylic acid
CID 79381622
N-[3-(ethylamino)-3-oxopropyl]pyrrolidine-1-carboxamide
CID 116657786
N-(3-oxo-3-pyrrolidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 113221674
N-[3-oxo-3-(propan-2-ylamino)propyl]azepane-1-carboxamide
CID 115583768
N-[3-(cyclopropylamino)propyl]azepane-1-carboxamide
CID 79152117
N-(3-oxo-3-piperidin-1-ylpropyl)pyrrolidine-1-carboxamide
CID 115583806
N-[2-(cycloheptylamino)ethyl]azepane-1-carboxamide
CID 115306511
N-[3-(tert-butylamino)-3-oxopropyl]piperidine-1-carboxamide
CID 115609267
N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide?
The IUPAC name of N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide (CID 116656665) is N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide.
What is the SMILES notation for N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide?
The canonical SMILES for N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide is O=C(CCNC(=O)N1CCCC1)NC1CC1.
What is the InChIKey of N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide?
The InChIKey is PDBKHNWZHYILDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O2/c15-10(13-9-3-4-9)5-6-12-11(16)14-7-1-2-8-14/h9H,1-8H2,(H,12,16)(H,13,15).
What are the key properties of N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide?
N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide has a molecular weight of 225.29 g/mol, XLogP of 0.46, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylamino)-3-oxopropyl]pyrrolidine-1-carboxamide is sourced from PubChem (CID 116656665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).