N-(2-cyclononylcyclopentyl)cyclododecanamine

C26H49N — CID 146530332

IUPACN-(2-cyclononylcyclopentyl)cyclododecanamine
SMILESC1CCCCCC(NC2CCCC2C2CCCCCCCC2)CCCCC1
InChIInChI=1S/C26H49N/c1-2-4-10-14-19-24(20-15-11-5-3-1)27-26-22-16-21-25(26)23-17-12-8-6-7-9-13-18-23/h23-27H,1-22H2
InChIKeyJNBARADRJOFFOL-UHFFFAOYSA-N
MW375.69 g/mol
LogP8.17
Rot. Bonds3

About N-(2-cyclononylcyclopentyl)cyclododecanamine

N-(2-cyclononylcyclopentyl)cyclododecanamine (PubChem CID 146530332) has the molecular formula C26H49N and a molecular weight of 375.69 g/mol. Its IUPAC name is N-(2-cyclononylcyclopentyl)cyclododecanamine.

Molecular Properties

Compound NameN-(2-cyclononylcyclopentyl)cyclododecanamine
PubChem CID146530332
Molecular FormulaC26H49N
Molecular Weight375.69 g/mol
Exact Mass375.39
IUPAC NameN-(2-cyclononylcyclopentyl)cyclododecanamine
SMILESC1CCCCCC(NC2CCCC2C2CCCCCCCC2)CCCCC1
InChIInChI=1S/C26H49N/c1-2-4-10-14-19-24(20-15-11-5-3-1)27-26-22-16-21-25(26)23-17-12-8-6-7-9-13-18-23/h23-27H,1-22H2
InChIKeyJNBARADRJOFFOL-UHFFFAOYSA-N
XLogP8.17
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500375.69
LogP ≤ 58.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-(2-cycloundecylcyclopentyl)cycloundecanamine
CID 146492936
N-(2-cyclononylcyclopentyl)cycloundecanamine
CID 167283345
N-(2-cyclotridecylcycloheptyl)cyclotridecanamine
CID 156542642
N-cyclopropyl-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-4-amine
CID 83906411
2-cyclohexyl-N-(3-methylcyclohexyl)cyclohexan-1-amine
CID 43432566
N-[4-[4-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-1-ylamino)cyclohexyl]cyclohexyl]-1,2,3,4,4a,4b,5,6,7,8,8a,9,10,10a-tetradecahydrophenanthren-9-amine
CID 71129084
N-(2-chlorocyclopentyl)cycloheptanamine
CID 127002051
2-(cycloheptylamino)cyclopentan-1-ol
CID 60713716
N-[(1R,2R)-2-fluorocyclopentyl]cyclohexanamine
CID 126847823
N-(2-methoxycyclopentyl)cyclododecanamine
CID 63477774
N'-(2-cyclohexylcyclohexyl)ethane-1,2-diamine
CID 60889120
5-cyclohexyl-2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-benzo[7]annulene
CID 59124996

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclononylcyclopentyl)cyclododecanamine?
The IUPAC name of N-(2-cyclononylcyclopentyl)cyclododecanamine (CID 146530332) is N-(2-cyclononylcyclopentyl)cyclododecanamine.
What is the SMILES notation for N-(2-cyclononylcyclopentyl)cyclododecanamine?
The canonical SMILES for N-(2-cyclononylcyclopentyl)cyclododecanamine is C1CCCCCC(NC2CCCC2C2CCCCCCCC2)CCCCC1.
What is the InChIKey of N-(2-cyclononylcyclopentyl)cyclododecanamine?
The InChIKey is JNBARADRJOFFOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H49N/c1-2-4-10-14-19-24(20-15-11-5-3-1)27-26-22-16-21-25(26)23-17-12-8-6-7-9-13-18-23/h23-27H,1-22H2.
What are the key properties of N-(2-cyclononylcyclopentyl)cyclododecanamine?
N-(2-cyclononylcyclopentyl)cyclododecanamine has a molecular weight of 375.69 g/mol, XLogP of 8.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclononylcyclopentyl)cyclododecanamine is sourced from PubChem (CID 146530332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).