N,N-diethylcycloundecanamine

C15H31N — CID 163828609

IUPACN,N-diethylcycloundecanamine
SMILESCCN(CC)C1CCCCCCCCCC1
InChIInChI=1S/C15H31N/c1-3-16(4-2)15-13-11-9-7-5-6-8-10-12-14-15/h15H,3-14H2,1-2H3
InChIKeyOBSUPMPGKUIHAX-UHFFFAOYSA-N
MW225.42 g/mol
LogP4.61
Rot. Bonds3

About N,N-diethylcycloundecanamine

N,N-diethylcycloundecanamine (PubChem CID 163828609) has the molecular formula C15H31N and a molecular weight of 225.42 g/mol. Its IUPAC name is N,N-diethylcycloundecanamine.

Molecular Properties

Compound NameN,N-diethylcycloundecanamine
PubChem CID163828609
Molecular FormulaC15H31N
Molecular Weight225.42 g/mol
Exact Mass225.25
IUPAC NameN,N-diethylcycloundecanamine
SMILESCCN(CC)C1CCCCCCCCCC1
InChIInChI=1S/C15H31N/c1-3-16(4-2)15-13-11-9-7-5-6-8-10-12-14-15/h15H,3-14H2,1-2H3
InChIKeyOBSUPMPGKUIHAX-UHFFFAOYSA-N
XLogP4.61
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.42
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N,N-diethylcyclobutanamine;ethane
CID 170746144
N,N-diethyl-4-methylcycloheptan-1-amine;hydrofluoride
CID 23299105
N,N-dipropylcyclodecanamine
CID 139723962
1-N-cyclohexyl-1-N-ethylbutane-1,2-diamine
CID 43649724
2-[[cyclohexyl(ethyl)amino]methyl]cyclohexan-1-amine
CID 55093825
N-(4-chlorobut-2-enyl)-N-ethylcyclohexanamine
CID 77051732
1-cyclohexyl-2-[cyclopentyl(ethyl)amino]ethanone
CID 104750031
N-[(1-aminocyclopentyl)methyl]-N-ethylcyclohexanamine
CID 60852825
N-ethyl-N-(3-methylpentyl)cyclohexanamine
CID 142032540
1-cyclohexyl-N'-cyclopentyl-N'-ethylethane-1,2-diamine
CID 104744777
N,N-diethyl-4-methylcyclohexan-1-amine;ethane
CID 145372894
3-N,3-N-diethyl-1-N-methylcycloheptane-1,3-diamine
CID 83863334

Frequently Asked Questions

What is the IUPAC name of N,N-diethylcycloundecanamine?
The IUPAC name of N,N-diethylcycloundecanamine (CID 163828609) is N,N-diethylcycloundecanamine.
What is the SMILES notation for N,N-diethylcycloundecanamine?
The canonical SMILES for N,N-diethylcycloundecanamine is CCN(CC)C1CCCCCCCCCC1.
What is the InChIKey of N,N-diethylcycloundecanamine?
The InChIKey is OBSUPMPGKUIHAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N/c1-3-16(4-2)15-13-11-9-7-5-6-8-10-12-14-15/h15H,3-14H2,1-2H3.
What are the key properties of N,N-diethylcycloundecanamine?
N,N-diethylcycloundecanamine has a molecular weight of 225.42 g/mol, XLogP of 4.61, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylcycloundecanamine is sourced from PubChem (CID 163828609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).