N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride

C18H25ClN2O — CID 119427333

IUPACN-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)C1CC12CCCc1ccccc12
InChIInChI=1S/C18H24N2O.ClH/c21-17(20-14-7-4-10-19-12-14)16-11-18(16)9-3-6-13-5-1-2-8-15(13)18;/h1-2,5,8,14,16,19H,3-4,6-7,9-12H2,(H,20,21);1H
InChIKeyLDAYCQKDORRNBX-UHFFFAOYSA-N
MW320.86 g/mol
LogP2.57
Rot. Bonds2

About N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride

N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride (PubChem CID 119427333) has the molecular formula C18H25ClN2O and a molecular weight of 320.86 g/mol. Its IUPAC name is N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride
PubChem CID119427333
Molecular FormulaC18H25ClN2O
Molecular Weight320.86 g/mol
Exact Mass320.17
IUPAC NameN-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride
SMILESCl.O=C(NC1CCCNC1)C1CC12CCCc1ccccc12
InChIInChI=1S/C18H24N2O.ClH/c21-17(20-14-7-4-10-19-12-14)16-11-18(16)9-3-6-13-5-1-2-8-15(13)18;/h1-2,5,8,14,16,19H,3-4,6-7,9-12H2,(H,20,21);1H
InChIKeyLDAYCQKDORRNBX-UHFFFAOYSA-N
XLogP2.57
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.86
LogP ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-piperidin-3-ylspiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-carboxamide
CID 119426712
N-(2-piperidin-3-ylethyl)spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-carboxamide
CID 119557248
(1'S,4R)-N-[(1S,2R)-2-carbamoylcyclohexyl]spiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide
CID 124780671
(1'R,4S)-spiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxylic acid
CID 94419963
1-methyl-N-pyrrolidin-3-yl-3,4-dihydro-2H-naphthalene-1-carboxamide
CID 119449830
N-piperidin-3-yl-2,3-dihydro-1H-indene-2-carboxamide
CID 112531038
(1'R,4R)-spiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide
CID 97219151
N-piperidin-3-yl-1,2,3,4-tetrahydronaphthalene-2-carboxamide
CID 107126396
N-propyl-N-pyrrolidin-3-ylspiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-carboxamide
CID 119531474
[3-(methylamino)piperidin-1-yl]-spiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-ylmethanone;hydrochloride
CID 119490666
(1'R,4S)-N-[2-(1H-1,2,4-triazol-5-yl)phenyl]spiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide
CID 124882366
N-piperidin-3-yl-2,3-dihydro-1-benzothiophene-2-carboxamide;hydrochloride
CID 119426947

Frequently Asked Questions

What is the IUPAC name of N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride?
The IUPAC name of N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride (CID 119427333) is N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride.
What is the SMILES notation for N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride?
The canonical SMILES for N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride is Cl.O=C(NC1CCCNC1)C1CC12CCCc1ccccc12.
What is the InChIKey of N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride?
The InChIKey is LDAYCQKDORRNBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O.ClH/c21-17(20-14-7-4-10-19-12-14)16-11-18(16)9-3-6-13-5-1-2-8-15(13)18;/h1-2,5,8,14,16,19H,3-4,6-7,9-12H2,(H,20,21);1H.
What are the key properties of N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride?
N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride has a molecular weight of 320.86 g/mol, XLogP of 2.57, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-ylspiro[2,3-dihydro-1H-naphthalene-4,2'-cyclopropane]-1'-carboxamide;hydrochloride is sourced from PubChem (CID 119427333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).