1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine

C22H38N2 — CID 20530659

IUPAC1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine
SMILESC=C(N(C1CCCCC1)C1CCCCC1)N(C1CCC1)C1CCC1
InChIInChI=1S/C22H38N2/c1-18(24(21-14-8-15-21)22-16-9-17-22)23(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h19-22H,1-17H2
InChIKeyBWHLJFCFBCBGOZ-UHFFFAOYSA-N
MW330.56 g/mol
LogP5.83
Rot. Bonds6

About 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine

1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine (PubChem CID 20530659) has the molecular formula C22H38N2 and a molecular weight of 330.56 g/mol. Its IUPAC name is 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine.

Molecular Properties

Compound Name1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine
PubChem CID20530659
Molecular FormulaC22H38N2
Molecular Weight330.56 g/mol
Exact Mass330.30
IUPAC Name1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine
SMILESC=C(N(C1CCCCC1)C1CCCCC1)N(C1CCC1)C1CCC1
InChIInChI=1S/C22H38N2/c1-18(24(21-14-8-15-21)22-16-9-17-22)23(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h19-22H,1-17H2
InChIKeyBWHLJFCFBCBGOZ-UHFFFAOYSA-N
XLogP5.83
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500330.56
LogP ≤ 55.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-[3,5-bis[1-(dicyclohexylamino)ethenyl]phenyl]ethenyl]-N-cyclohexylcyclohexanamine
CID 171722657
1,1,3,3-tetracyclohexylselenourea
CID 134917279
1,1,3,3-tetracyclohexylthiourea
CID 12935848
1-cycloheptyl-1,2,2-tricyclohexylhydrazine
CID 139397453
CID 87476940
CID 87476940
1,1,3,3-tetracyclopentylguanidine
CID 68836452
N,N-dicyclohexylcyclobutanecarboxamide
CID 841777
bis(N,N-dicyclohexylcarbamodithioate);molybdenum;disulfide
CID 173360149
cyclohexyl-(2-methylidenecyclohexyl)carbamodithioic acid
CID 151798740
N,N-dicyclohexylcyclohexanamine
CID 175770337
N,N-dicyclohexyl-2-iodoacetamide
CID 71405486
2-amino-N-cyclohexyl-N-ethyl-3-methylbutanamide;hydrochloride
CID 56831854

Frequently Asked Questions

What is the IUPAC name of 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine?
The IUPAC name of 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine (CID 20530659) is 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine.
What is the SMILES notation for 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine?
The canonical SMILES for 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine is C=C(N(C1CCCCC1)C1CCCCC1)N(C1CCC1)C1CCC1.
What is the InChIKey of 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine?
The InChIKey is BWHLJFCFBCBGOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H38N2/c1-18(24(21-14-8-15-21)22-16-9-17-22)23(19-10-4-2-5-11-19)20-12-6-3-7-13-20/h19-22H,1-17H2.
What are the key properties of 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine?
1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine has a molecular weight of 330.56 g/mol, XLogP of 5.83, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N',1-N'-di(cyclobutyl)-1-N,1-N-dicyclohexylethene-1,1-diamine is sourced from PubChem (CID 20530659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).