(2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide

C11H21N3O2 — CID 94219249

IUPAC(2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide
SMILESC[C@H](C(=O)NC(N)=O)N(C)CC1CCCC1
InChIInChI=1S/C11H21N3O2/c1-8(10(15)13-11(12)16)14(2)7-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H3,12,13,15,16)/t8-/m1/s1
InChIKeyMNJDQZSMVBGFND-MRVPVSSYSA-N
MW227.31 g/mol
LogP0.69
Rot. Bonds4

About (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide

(2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide (PubChem CID 94219249) has the molecular formula C11H21N3O2 and a molecular weight of 227.31 g/mol. Its IUPAC name is (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide.

Molecular Properties

Compound Name(2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide
PubChem CID94219249
Molecular FormulaC11H21N3O2
Molecular Weight227.31 g/mol
Exact Mass227.16
IUPAC Name(2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide
SMILESC[C@H](C(=O)NC(N)=O)N(C)CC1CCCC1
InChIInChI=1S/C11H21N3O2/c1-8(10(15)13-11(12)16)14(2)7-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H3,12,13,15,16)/t8-/m1/s1
InChIKeyMNJDQZSMVBGFND-MRVPVSSYSA-N
XLogP0.69
TPSA75.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.31
LogP ≤ 50.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide?
The IUPAC name of (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide (CID 94219249) is (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide.
What is the SMILES notation for (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide?
The canonical SMILES for (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide is C[C@H](C(=O)NC(N)=O)N(C)CC1CCCC1.
What is the InChIKey of (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide?
The InChIKey is MNJDQZSMVBGFND-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H21N3O2/c1-8(10(15)13-11(12)16)14(2)7-9-5-3-4-6-9/h8-9H,3-7H2,1-2H3,(H3,12,13,15,16)/t8-/m1/s1.
What are the key properties of (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide?
(2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide has a molecular weight of 227.31 g/mol, XLogP of 0.69, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-carbamoyl-2-[cyclopentylmethyl(methyl)amino]propanamide is sourced from PubChem (CID 94219249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).