(2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide

C15H19N3O2 — CID 97061659

IUPAC(2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
SMILESCO[C@H](C)C(=O)N(Cc1ccccc1)Cc1ccn[nH]1
InChIInChI=1S/C15H19N3O2/c1-12(20-2)15(19)18(11-14-8-9-16-17-14)10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,16,17)/t12-/m1/s1
InChIKeyLKZWXQFZGBJDPT-GFCCVEGCSA-N
MW273.34 g/mol
LogP1.97
Rot. Bonds6

About (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide

(2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide (PubChem CID 97061659) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide.

Molecular Properties

Compound Name(2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
PubChem CID97061659
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name(2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
SMILESCO[C@H](C)C(=O)N(Cc1ccccc1)Cc1ccn[nH]1
InChIInChI=1S/C15H19N3O2/c1-12(20-2)15(19)18(11-14-8-9-16-17-14)10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,16,17)/t12-/m1/s1
InChIKeyLKZWXQFZGBJDPT-GFCCVEGCSA-N
XLogP1.97
TPSA58.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-benzyl-2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 95157473
N-benzyl-4,4,4-trifluoro-3-methoxy-N-(1H-pyrazol-5-ylmethyl)butanamide
CID 166240629
N-benzyl-N-(1H-pyrazol-5-ylmethyl)oxirane-2-carboxamide
CID 154879911
N-benzyl-2-methoxy-N-methylpropanamide
CID 112685507
N-benzyl-2-methoxy-N-propan-2-ylpropanamide
CID 115588172
(2S)-N,N-dibenzyl-2-(2-methoxyphenoxy)propanamide
CID 40742883
2-phenylmethoxy-N-(1H-pyrazol-5-ylmethyl)propanamide
CID 47286046
[1-(dibenzylamino)-1-oxopropan-2-yl] 2-phenylacetate
CID 55319467
(111C)methyl N,N-dibenzylcarbamate
CID 10106358
2-[benzyl-[2-(4-methoxyphenoxy)propanoyl]amino]acetic acid
CID 119196968
2-[benzyl(2-methoxyethyl)amino]-2-oxoacetic acid
CID 127020353
(2S)-3-methyl-2-[(2-phenylacetyl)amino]-N-(1H-pyrazol-5-ylmethyl)butanamide
CID 94032780

Frequently Asked Questions

What is the IUPAC name of (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
The IUPAC name of (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide (CID 97061659) is (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide.
What is the SMILES notation for (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
The canonical SMILES for (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide is CO[C@H](C)C(=O)N(Cc1ccccc1)Cc1ccn[nH]1.
What is the InChIKey of (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
The InChIKey is LKZWXQFZGBJDPT-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-12(20-2)15(19)18(11-14-8-9-16-17-14)10-13-6-4-3-5-7-13/h3-9,12H,10-11H2,1-2H3,(H,16,17)/t12-/m1/s1.
What are the key properties of (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide?
(2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide has a molecular weight of 273.34 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-benzyl-2-methoxy-N-(1H-pyrazol-5-ylmethyl)propanamide is sourced from PubChem (CID 97061659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).