N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide

C17H26N2O2 — CID 43136887

IUPACN-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide
SMILESNCCCN(C(=O)c1ccc(O)cc1)C1CCCCCC1
InChIInChI=1S/C17H26N2O2/c18-12-5-13-19(15-6-3-1-2-4-7-15)17(21)14-8-10-16(20)11-9-14/h8-11,15,20H,1-7,12-13,18H2
InChIKeyGEDVKINRLRGCLC-UHFFFAOYSA-N
MW290.41 g/mol
LogP2.91
Rot. Bonds5

About N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide

N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide (PubChem CID 43136887) has the molecular formula C17H26N2O2 and a molecular weight of 290.41 g/mol. Its IUPAC name is N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide
PubChem CID43136887
Molecular FormulaC17H26N2O2
Molecular Weight290.41 g/mol
Exact Mass290.20
IUPAC NameN-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide
SMILESNCCCN(C(=O)c1ccc(O)cc1)C1CCCCCC1
InChIInChI=1S/C17H26N2O2/c18-12-5-13-19(15-6-3-1-2-4-7-15)17(21)14-8-10-16(20)11-9-14/h8-11,15,20H,1-7,12-13,18H2
InChIKeyGEDVKINRLRGCLC-UHFFFAOYSA-N
XLogP2.91
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.41
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(3-aminopropyl)-N-cyclopentyl-3,4-dihydroxybenzamide
CID 107727819
N-(3-aminopropyl)-N-cycloheptylfuran-3-carboxamide
CID 43136891
N-(3-aminopropyl)-N-cycloheptylpyridazine-4-carboxamide
CID 104668877
N-(3-aminopropyl)-N-cyclohexylpyridine-3-carboxamide
CID 43319410
N-(3-aminopropyl)-N-cycloheptyl-3-fluorobenzamide
CID 43319433
N-(3-aminopropyl)-N-cyclopropyl-4-ethylbenzamide
CID 43136724
1-N,4-N-dicyclohexyl-1-N,4-N-bis(2-hydroxyethyl)benzene-1,4-dicarboxamide
CID 3317185
N-(3-aminopropyl)-N-cycloheptyl-1-methylpyrazole-3-carboxamide
CID 103115758
N-(3-aminopropyl)-N-cyclopropyl-4-methoxybenzamide
CID 43136784
N-(3-aminopropyl)-N-cyclopentylpyridine-3-carboxamide
CID 43136838
N-(3-aminopropyl)-N-cycloheptyl-2-methylpyridine-4-carboxamide
CID 106752285
N-(3-aminopropyl)-N-cyclohexyl-3-methoxybenzamide
CID 43319405

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide?
The IUPAC name of N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide (CID 43136887) is N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide.
What is the SMILES notation for N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide?
The canonical SMILES for N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide is NCCCN(C(=O)c1ccc(O)cc1)C1CCCCCC1.
What is the InChIKey of N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide?
The InChIKey is GEDVKINRLRGCLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26N2O2/c18-12-5-13-19(15-6-3-1-2-4-7-15)17(21)14-8-10-16(20)11-9-14/h8-11,15,20H,1-7,12-13,18H2.
What are the key properties of N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide?
N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide has a molecular weight of 290.41 g/mol, XLogP of 2.91, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-N-cycloheptyl-4-hydroxybenzamide is sourced from PubChem (CID 43136887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).