(2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide

C11H22N4O2 — CID 119552995

IUPAC(2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide
SMILESCCC[C@@H](NC(N)=O)C(=O)N(C)C1CCNC1
InChIInChI=1S/C11H22N4O2/c1-3-4-9(14-11(12)17)10(16)15(2)8-5-6-13-7-8/h8-9,13H,3-7H2,1-2H3,(H3,12,14,17)/t8?,9-/m1/s1
InChIKeyIXKZTAWACJQIPJ-YGPZHTELSA-N
MW242.32 g/mol
LogP-0.36
Rot. Bonds5

About (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide

(2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide (PubChem CID 119552995) has the molecular formula C11H22N4O2 and a molecular weight of 242.32 g/mol. Its IUPAC name is (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide.

Molecular Properties

Compound Name(2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide
PubChem CID119552995
Molecular FormulaC11H22N4O2
Molecular Weight242.32 g/mol
Exact Mass242.17
IUPAC Name(2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide
SMILESCCC[C@@H](NC(N)=O)C(=O)N(C)C1CCNC1
InChIInChI=1S/C11H22N4O2/c1-3-4-9(14-11(12)17)10(16)15(2)8-5-6-13-7-8/h8-9,13H,3-7H2,1-2H3,(H3,12,14,17)/t8?,9-/m1/s1
InChIKeyIXKZTAWACJQIPJ-YGPZHTELSA-N
XLogP-0.36
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 5-0.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide?
The IUPAC name of (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide (CID 119552995) is (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide.
What is the SMILES notation for (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide?
The canonical SMILES for (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide is CCC[C@@H](NC(N)=O)C(=O)N(C)C1CCNC1.
What is the InChIKey of (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide?
The InChIKey is IXKZTAWACJQIPJ-YGPZHTELSA-N. The full InChI is InChI=1S/C11H22N4O2/c1-3-4-9(14-11(12)17)10(16)15(2)8-5-6-13-7-8/h8-9,13H,3-7H2,1-2H3,(H3,12,14,17)/t8?,9-/m1/s1.
What are the key properties of (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide?
(2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide has a molecular weight of 242.32 g/mol, XLogP of -0.36, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-(carbamoylamino)-N-methyl-N-pyrrolidin-3-ylpentanamide is sourced from PubChem (CID 119552995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).