1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide

C16H18N2O — CID 142687635

IUPAC1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1Cc1cccc2ccccc12
InChIInChI=1S/C16H18N2O/c17-16(19)15-9-4-10-18(15)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-3,5-8,15H,4,9-11H2,(H2,17,19)
InChIKeyMVPFZXVISAUFAV-UHFFFAOYSA-N
MW254.33 g/mol
LogP2.29
Rot. Bonds3

About 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide

1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide (PubChem CID 142687635) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide.

Molecular Properties

Compound Name1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide
PubChem CID142687635
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide
SMILESNC(=O)C1CCCN1Cc1cccc2ccccc12
InChIInChI=1S/C16H18N2O/c17-16(19)15-9-4-10-18(15)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-3,5-8,15H,4,9-11H2,(H2,17,19)
InChIKeyMVPFZXVISAUFAV-UHFFFAOYSA-N
XLogP2.29
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 52.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(naphthalen-1-ylmethyl)piperidine-2-carboxylic acid
CID 5212584
(2R)-1-benzylpyrrolidine-2-carboxamide;hydrochloride
CID 141477985
1-[[3-(aminomethyl)-2-fluorophenyl]methyl]piperidine-2-carboxamide
CID 107113264
[1-(naphthalen-1-ylmethyl)pyrrolidin-2-yl]methanamine
CID 43187015
(2S)-1-[[2-(trifluoromethyl)phenyl]methyl]piperidine-2-carboxamide
CID 95146043
1-[(6-amino-2-pyridinyl)methyl]pyrrolidine-2-carboxamide
CID 79243973
methyl 2-[2-[(2-carbamoylpiperidin-1-yl)methyl]phenyl]acetate
CID 115462737
1-[1-(naphthalen-1-ylmethyl)pyrrolidin-2-yl]propan-2-ol
CID 115758703
1-[(2,4-dichlorophenyl)methyl]pyrrolidine-2-carboxamide
CID 171323663
1-[(4-aminophenyl)methyl]pyrrolidine-2-carboxamide
CID 43212133
(2R)-1-[[2-[(4-oxo-4-phenylbutanoyl)amino]phenyl]methyl]pyrrolidine-2-carboxamide
CID 52526979
1-[[2-[(4-phenylphenyl)sulfonylamino]phenyl]methyl]pyrrolidine-2-carboxamide
CID 102563725

Frequently Asked Questions

What is the IUPAC name of 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide?
The IUPAC name of 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide (CID 142687635) is 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide.
What is the SMILES notation for 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide?
The canonical SMILES for 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide is NC(=O)C1CCCN1Cc1cccc2ccccc12.
What is the InChIKey of 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide?
The InChIKey is MVPFZXVISAUFAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c17-16(19)15-9-4-10-18(15)11-13-7-3-6-12-5-1-2-8-14(12)13/h1-3,5-8,15H,4,9-11H2,(H2,17,19).
What are the key properties of 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide?
1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide has a molecular weight of 254.33 g/mol, XLogP of 2.29, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(naphthalen-1-ylmethyl)pyrrolidine-2-carboxamide is sourced from PubChem (CID 142687635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).