N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene

C23H28N2O2 — CID 145484429

IUPACN-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene
SMILESC=CC.CCC1(O)CCC(NC(=O)c2ccc3[nH]c4ccccc4c3c2)C1
InChIInChI=1S/C20H22N2O2.C3H6/c1-2-20(24)10-9-14(12-20)21-19(23)13-7-8-18-16(11-13)15-5-3-4-6-17(15)22-18;1-3-2/h3-8,11,14,22,24H,2,9-10,12H2,1H3,(H,21,23);3H,1H2,2H3
InChIKeyQUCULWXZOMQQNM-UHFFFAOYSA-N
MW364.49 g/mol
LogP4.94
Rot. Bonds3

About N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene

N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene (PubChem CID 145484429) has the molecular formula C23H28N2O2 and a molecular weight of 364.49 g/mol. Its IUPAC name is N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene.

Molecular Properties

Compound NameN-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene
PubChem CID145484429
Molecular FormulaC23H28N2O2
Molecular Weight364.49 g/mol
Exact Mass364.22
IUPAC NameN-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene
SMILESC=CC.CCC1(O)CCC(NC(=O)c2ccc3[nH]c4ccccc4c3c2)C1
InChIInChI=1S/C20H22N2O2.C3H6/c1-2-20(24)10-9-14(12-20)21-19(23)13-7-8-18-16(11-13)15-5-3-4-6-17(15)22-18;1-3-2/h3-8,11,14,22,24H,2,9-10,12H2,1H3,(H,21,23);3H,1H2,2H3
InChIKeyQUCULWXZOMQQNM-UHFFFAOYSA-N
XLogP4.94
TPSA65.12 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.49
LogP ≤ 54.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

N-(1,9-dioxaspiro[5.5]undecan-4-yl)-9-oxo-10H-acridine-2-carboxamide
CID 127984291
3-chloro-N-(4-ethyl-4-hydroxycyclohexyl)-4-methylbenzamide
CID 75399365
methyl 3-(9H-carbazol-3-yl)-3-oxopropanoate
CID 82667262
N-[(3S)-1-amino-3-methyl-1-oxopentan-2-yl]-9H-carbazole-3-carboxamide
CID 67461997
N-(2,2-dimethyloxan-4-yl)-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-carboxamide
CID 71754454
N-[(2S,3S)-1-amino-3-methyl-1-sulfanylidenepentan-2-yl]-9H-carbazole-3-carboxamide
CID 158196704
3-[(3E,5Z)-hepta-1,3,5-trien-4-yl]-9H-carbazole
CID 167223078
N-[(3S)-3-methyl-1-(oxan-4-ylmethylamino)-1-sulfanylidenepentan-2-yl]-9H-carbazole-3-carboxamide
CID 87200615
6-oxo-N-pyrrolidin-3-ylspiro[5,7,8,9-tetrahydrocyclohepta[b]indole-10,1'-cyclopropane]-2-carboxamide
CID 71276412
2-[2-(9H-carbazol-3-yl)-2-oxoethoxy]acetic acid
CID 61329919
4-[2-[(4-ethyl-4-hydroxycyclohexyl)amino]-2-oxoethyl]-3-methylbenzoic acid
CID 167982576
(6S)-N-[2-(1H-indol-3-yl)ethyl]-6-methyl-6,7,8,9-tetrahydro-5H-carbazole-3-carboxamide
CID 2114335

Frequently Asked Questions

What is the IUPAC name of N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene?
The IUPAC name of N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene (CID 145484429) is N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene.
What is the SMILES notation for N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene?
The canonical SMILES for N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene is C=CC.CCC1(O)CCC(NC(=O)c2ccc3[nH]c4ccccc4c3c2)C1.
What is the InChIKey of N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene?
The InChIKey is QUCULWXZOMQQNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2.C3H6/c1-2-20(24)10-9-14(12-20)21-19(23)13-7-8-18-16(11-13)15-5-3-4-6-17(15)22-18;1-3-2/h3-8,11,14,22,24H,2,9-10,12H2,1H3,(H,21,23);3H,1H2,2H3.
What are the key properties of N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene?
N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene has a molecular weight of 364.49 g/mol, XLogP of 4.94, 3 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethyl-3-hydroxycyclopentyl)-9H-carbazole-3-carboxamide;prop-1-ene is sourced from PubChem (CID 145484429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).