(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide

C17H25N3O3 — CID 95155506

IUPAC(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide
SMILESCOc1ccccc1CC1CCN([C@H](C)C(=O)NC(N)=O)CC1
InChIInChI=1S/C17H25N3O3/c1-12(16(21)19-17(18)22)20-9-7-13(8-10-20)11-14-5-3-4-6-15(14)23-2/h3-6,12-13H,7-11H2,1-2H3,(H3,18,19,21,22)/t12-/m1/s1
InChIKeyVGQZPNOUQBQOKB-GFCCVEGCSA-N
MW319.40 g/mol
LogP1.53
Rot. Bonds5

About (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide

(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide (PubChem CID 95155506) has the molecular formula C17H25N3O3 and a molecular weight of 319.40 g/mol. Its IUPAC name is (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide.

Molecular Properties

Compound Name(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide
PubChem CID95155506
Molecular FormulaC17H25N3O3
Molecular Weight319.40 g/mol
Exact Mass319.19
IUPAC Name(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide
SMILESCOc1ccccc1CC1CCN([C@H](C)C(=O)NC(N)=O)CC1
InChIInChI=1S/C17H25N3O3/c1-12(16(21)19-17(18)22)20-9-7-13(8-10-20)11-14-5-3-4-6-15(14)23-2/h3-6,12-13H,7-11H2,1-2H3,(H3,18,19,21,22)/t12-/m1/s1
InChIKeyVGQZPNOUQBQOKB-GFCCVEGCSA-N
XLogP1.53
TPSA84.66 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.40
LogP ≤ 51.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-(hydroxymethyl)piperidin-1-yl]-N-[1-(2-methoxyphenyl)ethyl]propanamide
CID 110891645
4-amino-1-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]pentan-1-one;hydrochloride
CID 120562065
(2S)-N-[2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]-2-oxoethyl]-2-methylbutanamide
CID 95278344
(2R)-N-carbamoyl-2-[(3S)-3-[(2-chlorophenoxy)methyl]piperidin-1-yl]propanamide
CID 124592872
N-[1-[(2R)-1-[(2-methoxyphenyl)methylamino]-1-oxopropan-2-yl]piperidin-4-yl]benzamide
CID 33108751
3-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanoic acid
CID 119921488
(1-aminocyclopropyl)-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]methanone
CID 119769086
N-cyclopropyl-2-[4-[2-(2-methoxyphenyl)acetyl]piperazin-1-yl]propanamide
CID 51329083
N'-[(2-methoxyphenyl)methyl]-N-[(1-propan-2-ylpiperidin-4-yl)methyl]oxamide
CID 16886626
(2S)-2-amino-1-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]-3,3-dimethylbutan-1-one;hydrochloride
CID 119769107
3-[1-[1-(carbamoylamino)-1-oxopropan-2-yl]piperidin-4-yl]propanoic acid
CID 62216175
2-[3-(hydroxymethyl)pyrrolidin-1-yl]-N-(2-methoxyphenyl)propanamide
CID 111543811

Frequently Asked Questions

What is the IUPAC name of (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide?
The IUPAC name of (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide (CID 95155506) is (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide.
What is the SMILES notation for (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide?
The canonical SMILES for (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide is COc1ccccc1CC1CCN([C@H](C)C(=O)NC(N)=O)CC1.
What is the InChIKey of (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide?
The InChIKey is VGQZPNOUQBQOKB-GFCCVEGCSA-N. The full InChI is InChI=1S/C17H25N3O3/c1-12(16(21)19-17(18)22)20-9-7-13(8-10-20)11-14-5-3-4-6-15(14)23-2/h3-6,12-13H,7-11H2,1-2H3,(H3,18,19,21,22)/t12-/m1/s1.
What are the key properties of (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide?
(2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide has a molecular weight of 319.40 g/mol, XLogP of 1.53, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-carbamoyl-2-[4-[(2-methoxyphenyl)methyl]piperidin-1-yl]propanamide is sourced from PubChem (CID 95155506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).