N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide

C12H24N2O2 — CID 103738634

IUPACN-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide
SMILESO=C(NCCNCCCCCCO)C1CC1
InChIInChI=1S/C12H24N2O2/c15-10-4-2-1-3-7-13-8-9-14-12(16)11-5-6-11/h11,13,15H,1-10H2,(H,14,16)
InChIKeyJLOVCYXRIPVBPK-UHFFFAOYSA-N
MW228.34 g/mol
LogP0.65
Rot. Bonds10

About N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide

N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide (PubChem CID 103738634) has the molecular formula C12H24N2O2 and a molecular weight of 228.34 g/mol. Its IUPAC name is N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide
PubChem CID103738634
Molecular FormulaC12H24N2O2
Molecular Weight228.34 g/mol
Exact Mass228.18
IUPAC NameN-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide
SMILESO=C(NCCNCCCCCCO)C1CC1
InChIInChI=1S/C12H24N2O2/c15-10-4-2-1-3-7-13-8-9-14-12(16)11-5-6-11/h11,13,15H,1-10H2,(H,14,16)
InChIKeyJLOVCYXRIPVBPK-UHFFFAOYSA-N
XLogP0.65
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.34
LogP ≤ 50.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(6-hydroxyhexyl)cyclopentanecarboxamide
CID 70973936
N-(6-hydroxyhexyl)-4-methylcyclohexane-1-carboxamide
CID 113351776
N-(4-hydroxybutyl)cyclopentanecarboxamide
CID 106843693
2-(6-hydroxyhexylamino)ethylurea
CID 107703572
N-(3-hydroxypropyl)cyclopentanecarboxamide
CID 43392689
4-methyl-N-[2-(propylamino)ethyl]cyclohexane-1-carboxamide
CID 115563516
12-(12-hydroxydodecylamino)dodecan-1-ol
CID 18618691
N-(4-hydroxybutyl)bicyclo[3.1.0]hexane-3-carboxamide
CID 106843014
N-[2-(2-sulfamoylethylamino)ethyl]cyclopropanecarboxamide
CID 115644272
4-(aminomethyl)-N-[2-(cyclopropanecarbonylamino)ethyl]cyclohexane-1-carboxamide
CID 104963779
N-(6-hydroxyhexyl)-3-(trifluoromethyl)cyclohexane-1-carboxamide
CID 103918890
N-[2-(propylamino)ethyl]cyclobutanecarboxamide
CID 62658991

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide?
The IUPAC name of N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide (CID 103738634) is N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide.
What is the SMILES notation for N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide?
The canonical SMILES for N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide is O=C(NCCNCCCCCCO)C1CC1.
What is the InChIKey of N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide?
The InChIKey is JLOVCYXRIPVBPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2/c15-10-4-2-1-3-7-13-8-9-14-12(16)11-5-6-11/h11,13,15H,1-10H2,(H,14,16).
What are the key properties of N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide?
N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide has a molecular weight of 228.34 g/mol, XLogP of 0.65, 10 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-hydroxyhexylamino)ethyl]cyclopropanecarboxamide is sourced from PubChem (CID 103738634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).