N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide

C15H20N2O — CID 54412767

IUPACN-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
SMILESO=C(NC1CCCc2ccccc21)N1CCCC1
InChIInChI=1S/C15H20N2O/c18-15(17-10-3-4-11-17)16-14-9-5-7-12-6-1-2-8-13(12)14/h1-2,6,8,14H,3-5,7,9-11H2,(H,16,18)
InChIKeyVVGZIFVVFAIHCG-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.87
Rot. Bonds1

About N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide

N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide (PubChem CID 54412767) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide.

Molecular Properties

Compound NameN-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
PubChem CID54412767
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC NameN-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide
SMILESO=C(NC1CCCc2ccccc21)N1CCCC1
InChIInChI=1S/C15H20N2O/c18-15(17-10-3-4-11-17)16-14-9-5-7-12-6-1-2-8-13(12)14/h1-2,6,8,14H,3-5,7,9-11H2,(H,16,18)
InChIKeyVVGZIFVVFAIHCG-UHFFFAOYSA-N
XLogP2.87
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]morpholine-4-carboxamide
CID 40653878
3-hydroxy-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperidine-1-carboxamide
CID 110882568
1-N-[(5R)-6,7,8,9-tetrahydro-5H-benzo[7]annulen-5-yl]piperidine-1,4-dicarboxamide
CID 95351345
N-(2,3-dihydro-1H-inden-1-yl)-3-hydroxypiperidine-1-carboxamide
CID 110882685
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]cyclopropanecarboxamide
CID 7688429
N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]carbamoyl fluoride
CID 90147743
N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]-4-(1,3-thiazol-2-yl)piperazine-1-carboxamide
CID 51957654
2-oxo-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]-1,3-dioxa-8-azaspiro[4.5]decane-8-carboxamide
CID 126436675
(3S)-1-N-phenyl-3-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperidine-1,3-dicarboxamide
CID 9081500
1-piperidin-1-yl-2-(1,2,3,4-tetrahydronaphthalen-1-ylamino)ethanone
CID 43410641
4-(1,2-oxazol-3-ylmethyl)-N-[(1R)-1,2,3,4-tetrahydronaphthalen-1-yl]piperazine-1-carboxamide
CID 95907905
1-N-cyclopentyl-3-N-(1,2,3,4-tetrahydronaphthalen-1-yl)piperazine-1,3-dicarboxamide
CID 69233352

Frequently Asked Questions

What is the IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide?
The IUPAC name of N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide (CID 54412767) is N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide.
What is the SMILES notation for N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide?
The canonical SMILES for N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide is O=C(NC1CCCc2ccccc21)N1CCCC1.
What is the InChIKey of N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide?
The InChIKey is VVGZIFVVFAIHCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c18-15(17-10-3-4-11-17)16-14-9-5-7-12-6-1-2-8-13(12)14/h1-2,6,8,14H,3-5,7,9-11H2,(H,16,18).
What are the key properties of N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide?
N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide has a molecular weight of 244.34 g/mol, XLogP of 2.87, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2,3,4-tetrahydronaphthalen-1-yl)pyrrolidine-1-carboxamide is sourced from PubChem (CID 54412767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).