N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide

C15H22N2O2 — CID 114760630

IUPACN-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide
SMILESCC(C)(C(=O)NCC1(O)CCNC1)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-14(2,12-6-4-3-5-7-12)13(18)17-11-15(19)8-9-16-10-15/h3-7,16,19H,8-11H2,1-2H3,(H,17,18)
InChIKeyYIKHTHDNYIHIKV-UHFFFAOYSA-N
MW262.35 g/mol
LogP0.80
Rot. Bonds4

About N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide

N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide (PubChem CID 114760630) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide.

Molecular Properties

Compound NameN-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide
PubChem CID114760630
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide
SMILESCC(C)(C(=O)NCC1(O)CCNC1)c1ccccc1
InChIInChI=1S/C15H22N2O2/c1-14(2,12-6-4-3-5-7-12)13(18)17-11-15(19)8-9-16-10-15/h3-7,16,19H,8-11H2,1-2H3,(H,17,18)
InChIKeyYIKHTHDNYIHIKV-UHFFFAOYSA-N
XLogP0.80
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-hydroxypyrrolidin-3-yl)methyl]-3-methyl-3-phenylbutanamide;hydrochloride
CID 154903606
2-methyl-N-[(2-methylpyrrolidin-2-yl)methyl]-2-phenylpropanamide
CID 114761846
2-amino-N-[(1-hydroxycycloheptyl)methyl]-2-phenylpropanamide
CID 65122706
N-[(1-hydroxycyclobutyl)methyl]-2-methyl-2-(4-methylphenyl)propanamide
CID 111445600
4-[[(2-methyl-2-phenylpropanoyl)amino]methyl]oxane-4-carboxylic acid
CID 120543239
N-[(3-hydroxypyrrolidin-3-yl)methyl]-4-phenoxybutanamide
CID 91836814
2-(3-hydroxypyrrolidin-3-yl)-N-phenylacetamide
CID 84724654
1-[[(3R)-3-hydroxypyrrolidin-3-yl]methyl]-3-naphthalen-1-ylurea
CID 124523480
3-(1,3-dihydroisoindol-2-yl)-N-[[(3S)-3-hydroxypyrrolidin-3-yl]methyl]propanamide
CID 124752089
3-[(3-hydroxypyrrolidin-3-yl)methyl]-1,1-dimethylurea
CID 114760994
2-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpropanamide
CID 120891055
N-(1-carbamothioylcyclopentyl)-2-methyl-2-phenylpropanamide
CID 61120513

Frequently Asked Questions

What is the IUPAC name of N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide?
The IUPAC name of N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide (CID 114760630) is N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide.
What is the SMILES notation for N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide?
The canonical SMILES for N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide is CC(C)(C(=O)NCC1(O)CCNC1)c1ccccc1.
What is the InChIKey of N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide?
The InChIKey is YIKHTHDNYIHIKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-14(2,12-6-4-3-5-7-12)13(18)17-11-15(19)8-9-16-10-15/h3-7,16,19H,8-11H2,1-2H3,(H,17,18).
What are the key properties of N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide?
N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide has a molecular weight of 262.35 g/mol, XLogP of 0.80, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-hydroxypyrrolidin-3-yl)methyl]-2-methyl-2-phenylpropanamide is sourced from PubChem (CID 114760630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).