N,N-dipropylcyclodecanamine

C16H33N — CID 139723962

IUPACN,N-dipropylcyclodecanamine
SMILESCCCN(CCC)C1CCCCCCCCC1
InChIInChI=1S/C16H33N/c1-3-14-17(15-4-2)16-12-10-8-6-5-7-9-11-13-16/h16H,3-15H2,1-2H3
InChIKeyZEDOZRASSKAOAJ-UHFFFAOYSA-N
MW239.45 g/mol
LogP5.00
Rot. Bonds5

About N,N-dipropylcyclodecanamine

N,N-dipropylcyclodecanamine (PubChem CID 139723962) has the molecular formula C16H33N and a molecular weight of 239.45 g/mol. Its IUPAC name is N,N-dipropylcyclodecanamine.

Molecular Properties

Compound NameN,N-dipropylcyclodecanamine
PubChem CID139723962
Molecular FormulaC16H33N
Molecular Weight239.45 g/mol
Exact Mass239.26
IUPAC NameN,N-dipropylcyclodecanamine
SMILESCCCN(CCC)C1CCCCCCCCC1
InChIInChI=1S/C16H33N/c1-3-14-17(15-4-2)16-12-10-8-6-5-7-9-11-13-16/h16H,3-15H2,1-2H3
InChIKeyZEDOZRASSKAOAJ-UHFFFAOYSA-N
XLogP5.00
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500239.45
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-butyl-N-propylcyclohexanamine
CID 15751893
N'-cyclohexyl-N'-propylethane-1,2-diamine
CID 61348599
N'-cyclohexyl-N-methyl-N'-propylethane-1,2-diamine
CID 82932420
N'-cycloheptyl-N-methyl-N'-propylethane-1,2-diamine
CID 82931038
N-(5-methylhexyl)-N-propylcyclohexanamine
CID 167070487
2-[cyclododecyl(propyl)amino]acetic acid
CID 65064979
N,N-diethylcycloundecanamine
CID 163828609
N,N-bis(2-chloroethyl)cyclooctanamine
CID 11075940
N-propyl-N-(pyrrolidin-2-ylmethyl)cyclohexanamine
CID 106603994
N'-cyclohexyl-N'-hexylethane-1,2-diamine
CID 63760462
N'-cyclohexyl-N'-heptylpropane-1,3-diamine
CID 43137640
2-[2-[cyclohexyl(propyl)amino]ethyl]guanidine;sulfuric acid;hydrate
CID 23619153

Frequently Asked Questions

What is the IUPAC name of N,N-dipropylcyclodecanamine?
The IUPAC name of N,N-dipropylcyclodecanamine (CID 139723962) is N,N-dipropylcyclodecanamine.
What is the SMILES notation for N,N-dipropylcyclodecanamine?
The canonical SMILES for N,N-dipropylcyclodecanamine is CCCN(CCC)C1CCCCCCCCC1.
What is the InChIKey of N,N-dipropylcyclodecanamine?
The InChIKey is ZEDOZRASSKAOAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H33N/c1-3-14-17(15-4-2)16-12-10-8-6-5-7-9-11-13-16/h16H,3-15H2,1-2H3.
What are the key properties of N,N-dipropylcyclodecanamine?
N,N-dipropylcyclodecanamine has a molecular weight of 239.45 g/mol, XLogP of 5.00, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dipropylcyclodecanamine is sourced from PubChem (CID 139723962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).