N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide

C18H26N2O — CID 119529985

IUPACN-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESCCCN(C(=O)c1ccc2c(c1)CCCC2)C1CCNC1
InChIInChI=1S/C18H26N2O/c1-2-11-20(17-9-10-19-13-17)18(21)16-8-7-14-5-3-4-6-15(14)12-16/h7-8,12,17,19H,2-6,9-11,13H2,1H3
InChIKeyMYCBNUOELMPXRT-UHFFFAOYSA-N
MW286.42 g/mol
LogP2.78
Rot. Bonds4

About N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide

N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide (PubChem CID 119529985) has the molecular formula C18H26N2O and a molecular weight of 286.42 g/mol. Its IUPAC name is N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide.

Molecular Properties

Compound NameN-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
PubChem CID119529985
Molecular FormulaC18H26N2O
Molecular Weight286.42 g/mol
Exact Mass286.20
IUPAC NameN-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide
SMILESCCCN(C(=O)c1ccc2c(c1)CCCC2)C1CCNC1
InChIInChI=1S/C18H26N2O/c1-2-11-20(17-9-10-19-13-17)18(21)16-8-7-14-5-3-4-6-15(14)12-16/h7-8,12,17,19H,2-6,9-11,13H2,1H3
InChIKeyMYCBNUOELMPXRT-UHFFFAOYSA-N
XLogP2.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.42
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-N,1-N-dimethyl-3-N-propyl-3-N-pyrrolidin-3-ylbenzene-1,3-dicarboxamide
CID 119533174
4-bromo-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119532826
N-propyl-N-pyrrolidin-3-yl-1-benzothiophene-5-carboxamide
CID 119531080
2-methyl-N-propyl-N-pyrrolidin-3-ylpyridine-4-carboxamide
CID 106753627
N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophene-2-carboxamide
CID 63300923
6-oxo-N-propyl-N-pyrrolidin-3-yl-1H-pyridine-3-carboxamide
CID 63300842
N-propyl-N-pyrrolidin-3-yl-4-(sulfamoylmethyl)benzamide
CID 119530020
1-N-methyl-3-N-propyl-3-N-pyrrolidin-3-ylbenzene-1,3-dicarboxamide
CID 119533221
3-methoxy-N-propyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119533031
4-fluoro-3-methyl-N-piperidin-3-yl-N-propylbenzamide
CID 63209531
N-propyl-N-pyrrolidin-3-yl-3,5-bis(trifluoromethyl)benzamide
CID 119531195
4-(carbamoylamino)-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 119530230

Frequently Asked Questions

What is the IUPAC name of N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The IUPAC name of N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide (CID 119529985) is N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide.
What is the SMILES notation for N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The canonical SMILES for N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide is CCCN(C(=O)c1ccc2c(c1)CCCC2)C1CCNC1.
What is the InChIKey of N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
The InChIKey is MYCBNUOELMPXRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O/c1-2-11-20(17-9-10-19-13-17)18(21)16-8-7-14-5-3-4-6-15(14)12-16/h7-8,12,17,19H,2-6,9-11,13H2,1H3.
What are the key properties of N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide?
N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide has a molecular weight of 286.42 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-pyrrolidin-3-yl-5,6,7,8-tetrahydronaphthalene-2-carboxamide is sourced from PubChem (CID 119529985), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).