N-(1-cyclopropylethyl)undecan-6-amine

C16H33N — CID 43776560

IUPACN-(1-cyclopropylethyl)undecan-6-amine
SMILESCCCCCC(CCCCC)NC(C)C1CC1
InChIInChI=1S/C16H33N/c1-4-6-8-10-16(11-9-7-5-2)17-14(3)15-12-13-15/h14-17H,4-13H2,1-3H3
InChIKeyHWYOTIZEHGLBCT-UHFFFAOYSA-N
MW239.45 g/mol
LogP4.90
Rot. Bonds11

About N-(1-cyclopropylethyl)undecan-6-amine

N-(1-cyclopropylethyl)undecan-6-amine (PubChem CID 43776560) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is N-(1-cyclopropylethyl)undecan-6-amine.

Molecular Properties

Compound NameN-(1-cyclopropylethyl)undecan-6-amine
PubChem CID43776560
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC NameN-(1-cyclopropylethyl)undecan-6-amine
SMILESCCCCCC(CCCCC)NC(C)C1CC1
InChIInChI=1S/C16H33N/c1-4-6-8-10-16(11-9-7-5-2)17-14(3)15-12-13-15/h14-17H,4-13H2,1-3H3
InChIKeyHWYOTIZEHGLBCT-UHFFFAOYSA-N
XLogP4.90
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.45
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(1-cyclopropylethyl)hexan-2-amine
CID 43776552
N-[(1S)-1-cyclohexylethyl]heptan-3-amine
CID 81387279
N-[(1R)-1-cycloheptylethyl]heptan-2-amine
CID 81390133
N-[1-(1-ethylpiperidin-4-yl)ethyl]octan-4-amine
CID 106023059
1-(decan-5-ylamino)ethanol
CID 174223267
N-propan-2-ylheptadecan-5-amine
CID 79412665
N-propan-2-yltridecan-5-amine
CID 79413155
N-propan-2-yldodecan-5-amine
CID 79412905
octan-2-ylcyclopropane
CID 18968125
N-(1-cyclopropylethyl)dodecan-1-amine
CID 55195999
tert-butyl N-[2-(1-cyclopropylethylamino)hexyl]carbamate
CID 103788606
1-cyclopropyl-N-propylhexan-1-amine
CID 62600983

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylethyl)undecan-6-amine?
The IUPAC name of N-(1-cyclopropylethyl)undecan-6-amine (CID 43776560) is N-(1-cyclopropylethyl)undecan-6-amine.
What is the SMILES notation for N-(1-cyclopropylethyl)undecan-6-amine?
The canonical SMILES for N-(1-cyclopropylethyl)undecan-6-amine is CCCCCC(CCCCC)NC(C)C1CC1.
What is the InChIKey of N-(1-cyclopropylethyl)undecan-6-amine?
The InChIKey is HWYOTIZEHGLBCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-4-6-8-10-16(11-9-7-5-2)17-14(3)15-12-13-15/h14-17H,4-13H2,1-3H3.
What are the key properties of N-(1-cyclopropylethyl)undecan-6-amine?
N-(1-cyclopropylethyl)undecan-6-amine has a molecular weight of 239.45 g/mol, XLogP of 4.90, 11 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylethyl)undecan-6-amine is sourced from PubChem (CID 43776560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).