(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide

C9H17N3O — CID 131181581

IUPAC(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide
SMILESO=C(NCC1CNC1)[C@@H]1CCNC1
InChIInChI=1S/C9H17N3O/c13-9(8-1-2-10-6-8)12-5-7-3-11-4-7/h7-8,10-11H,1-6H2,(H,12,13)/t8-/m1/s1
InChIKeyVYNAUOQMXVVEFS-MRVPVSSYSA-N
MW183.25 g/mol
LogP-1.07
Rot. Bonds3

About (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide

(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide (PubChem CID 131181581) has the molecular formula C9H17N3O and a molecular weight of 183.25 g/mol. Its IUPAC name is (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide
PubChem CID131181581
Molecular FormulaC9H17N3O
Molecular Weight183.25 g/mol
Exact Mass183.14
IUPAC Name(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide
SMILESO=C(NCC1CNC1)[C@@H]1CCNC1
InChIInChI=1S/C9H17N3O/c13-9(8-1-2-10-6-8)12-5-7-3-11-4-7/h7-8,10-11H,1-6H2,(H,12,13)/t8-/m1/s1
InChIKeyVYNAUOQMXVVEFS-MRVPVSSYSA-N
XLogP-1.07
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.25
LogP ≤ 5-1.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1-methylpyrrolidin-3-yl)methyl]pyrrolidine-3-carboxamide
CID 63006550
N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 43371173
(3S)-N-(cyclopentylmethyl)piperidine-3-carboxamide
CID 81123262
N-[(2-methylcyclopropyl)methyl]pyrrolidine-3-carboxamide
CID 115738405
N-(2-fluoroethyl)pyrrolidine-3-carboxamide
CID 76624204
N-(piperidin-3-ylmethyl)cyclohexanecarboxamide
CID 18069614
N-[[(3R)-piperidin-3-yl]methyl]cycloheptanecarboxamide
CID 94502290
N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 53410772
(3S)-N-(oxan-4-ylmethyl)piperidine-3-carboxamide
CID 81141151
N-(2-fluoroethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 87325134
(3S)-N-prop-2-enylpyrrolidine-3-carboxamide
CID 94915636
(3S)-N-(2-amino-2-oxoethyl)pyrrolidine-3-carboxamide;hydrochloride
CID 130670847

Frequently Asked Questions

What is the IUPAC name of (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide?
The IUPAC name of (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide (CID 131181581) is (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide?
The canonical SMILES for (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide is O=C(NCC1CNC1)[C@@H]1CCNC1.
What is the InChIKey of (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide?
The InChIKey is VYNAUOQMXVVEFS-MRVPVSSYSA-N. The full InChI is InChI=1S/C9H17N3O/c13-9(8-1-2-10-6-8)12-5-7-3-11-4-7/h7-8,10-11H,1-6H2,(H,12,13)/t8-/m1/s1.
What are the key properties of (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide?
(3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide has a molecular weight of 183.25 g/mol, XLogP of -1.07, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-N-(azetidin-3-ylmethyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 131181581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).