N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine

C18H32N2 — CID 54328538

IUPACN-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine
SMILESCC/C(=N\C1=CCCCC1)C(CC)NC1CCCCC1
InChIInChI=1S/C18H32N2/c1-3-17(19-15-11-7-5-8-12-15)18(4-2)20-16-13-9-6-10-14-16/h11,16,18,20H,3-10,12-14H2,1-2H3/b19-17+
InChIKeySWRKTGNASTYSJM-HTXNQAPBSA-N
MW276.47 g/mol
LogP5.00
Rot. Bonds6

About N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine

N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine (PubChem CID 54328538) has the molecular formula C18H32N2 and a molecular weight of 276.47 g/mol. Its IUPAC name is N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine.

Molecular Properties

Compound NameN-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine
PubChem CID54328538
Molecular FormulaC18H32N2
Molecular Weight276.47 g/mol
Exact Mass276.26
IUPAC NameN-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine
SMILESCC/C(=N\C1=CCCCC1)C(CC)NC1CCCCC1
InChIInChI=1S/C18H32N2/c1-3-17(19-15-11-7-5-8-12-15)18(4-2)20-16-13-9-6-10-14-16/h11,16,18,20H,3-10,12-14H2,1-2H3/b19-17+
InChIKeySWRKTGNASTYSJM-HTXNQAPBSA-N
XLogP5.00
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.47
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

1,2,3,4,4a,5,5a,6,7,8-Decahydrophenazine
CID 53438523
N-[(Z)-4-cyclohexyliminopent-2-en-2-yl]cyclohexanamine
CID 23578229
N-[(E)-1-tert-butyliminohept-2-en-3-yl]cyclohexanamine
CID 12065549
N-[2-(cyclohexen-1-ylimino)ethyl]cyclohexanamine
CID 54273635
(1R,6R,11R,17Z,20R)-16,18-dimethyl-2,5,12,15,19-pentazatricyclo[18.4.0.06,11]tetracosa-15,17-diene
CID 59529657
(1R,6R,11R,20R)-16,18-dimethyl-2,5,12,15,19-pentazatricyclo[18.4.0.06,11]tetracosa-15,17-diene
CID 70838047
N-[(E)-4-piperidin-2-ylbut-2-en-2-yl]propan-2-imine
CID 123211008
N-[3-[(6E,10Z)-dodeca-6,10-dienyl]iminobutyl]pentan-3-amine
CID 129214843
N-(1-prop-1-en-2-yliminobutan-2-yl)cyclohex-3-en-1-amine
CID 138549377
(2Z)-3-(cyclohexylideneamino)cyclododec-2-en-1-amine
CID 138718256
N-[2-(7-methyl-2-pentyl-4H-azepin-6-yl)ethyl]prop-1-en-2-amine
CID 139384277
(Z)-7-butan-2-ylimino-N-propylhept-2-en-3-amine;ethene
CID 142806830

Frequently Asked Questions

What is the IUPAC name of N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine?
The IUPAC name of N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine (CID 54328538) is N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine.
What is the SMILES notation for N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine?
The canonical SMILES for N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine is CC/C(=N\C1=CCCCC1)C(CC)NC1CCCCC1.
What is the InChIKey of N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine?
The InChIKey is SWRKTGNASTYSJM-HTXNQAPBSA-N. The full InChI is InChI=1S/C18H32N2/c1-3-17(19-15-11-7-5-8-12-15)18(4-2)20-16-13-9-6-10-14-16/h11,16,18,20H,3-10,12-14H2,1-2H3/b19-17+.
What are the key properties of N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine?
N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine has a molecular weight of 276.47 g/mol, XLogP of 5.00, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(cyclohexen-1-ylimino)hexan-3-yl]cyclohexanamine is sourced from PubChem (CID 54328538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).