N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine

C19H24N2 — CID 141067325

IUPACN-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine
SMILESCC1=CC=CC1c1ccccc1C=NNC1CCCCC1
InChIInChI=1S/C19H24N2/c1-15-8-7-13-18(15)19-12-6-5-9-16(19)14-20-21-17-10-3-2-4-11-17/h5-9,12-14,17-18,21H,2-4,10-11H2,1H3
InChIKeyVPOGKTLUWGKDTN-UHFFFAOYSA-N
MW280.42 g/mol
LogP4.54
Rot. Bonds4

About N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine

N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine (PubChem CID 141067325) has the molecular formula C19H24N2 and a molecular weight of 280.42 g/mol. Its IUPAC name is N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine.

Molecular Properties

Compound NameN-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine
PubChem CID141067325
Molecular FormulaC19H24N2
Molecular Weight280.42 g/mol
Exact Mass280.19
IUPAC NameN-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine
SMILESCC1=CC=CC1c1ccccc1C=NNC1CCCCC1
InChIInChI=1S/C19H24N2/c1-15-8-7-13-18(15)19-12-6-5-9-16(19)14-20-21-17-10-3-2-4-11-17/h5-9,12-14,17-18,21H,2-4,10-11H2,1H3
InChIKeyVPOGKTLUWGKDTN-UHFFFAOYSA-N
XLogP4.54
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.42
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[[2-[3-(dimethylamino)cyclopenta-2,4-dien-1-yl]phenyl]methylideneamino]cyclohexanamine
CID 141067374
2-(2-methylcyclopenta-2,4-dien-1-yl)benzaldehyde
CID 154426433
5-[2-[(tert-butylhydrazinylidene)methyl]phenyl]-N,N-dimethylcyclopenta-1,3-dien-1-amine
CID 141067018
N-[(E)-[2-(2-tert-butylcyclopenta-1,3-dien-1-yl)phenyl]methylideneamino]cyclohexanamine
CID 23015761
N-[(E)-pyren-1-ylmethylideneamino]cyclohexanamine
CID 20816730
2-methyl-N-[2-[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]propan-2-yl]propan-2-amine
CID 154499995
1-cyclohexyl-3-[(Z)-(2-heptoxyphenyl)methylideneamino]thiourea
CID 110534061
1-cyclohexyl-3-[(Z)-(2-propoxyphenyl)methylideneamino]thiourea
CID 112538714
1-cyclohexyl-3-[(Z)-[2-(2-methylpropoxy)phenyl]methylideneamino]thiourea
CID 110536885
1-cyclohexyl-3-[(E)-(2-nitrophenyl)methylideneamino]thiourea
CID 6904278
N-[[2-(1,3-dioxan-2-yl)phenyl]methylideneamino]aniline
CID 169382596
N-cyclopentyl-N'-[(Z)-(2-ethoxyphenyl)methylideneamino]oxamide
CID 94846855

Frequently Asked Questions

What is the IUPAC name of N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine?
The IUPAC name of N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine (CID 141067325) is N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine.
What is the SMILES notation for N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine?
The canonical SMILES for N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine is CC1=CC=CC1c1ccccc1C=NNC1CCCCC1.
What is the InChIKey of N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine?
The InChIKey is VPOGKTLUWGKDTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2/c1-15-8-7-13-18(15)19-12-6-5-9-16(19)14-20-21-17-10-3-2-4-11-17/h5-9,12-14,17-18,21H,2-4,10-11H2,1H3.
What are the key properties of N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine?
N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine has a molecular weight of 280.42 g/mol, XLogP of 4.54, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(2-methylcyclopenta-2,4-dien-1-yl)phenyl]methylideneamino]cyclohexanamine is sourced from PubChem (CID 141067325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).