N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane

C19H38N2 — CID 144654671

IUPACN,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane
SMILESC=C/C(CN(C)C1CCC(C)CC1)=N\C=C/C.CC.CC
InChIInChI=1S/C15H26N2.2C2H6/c1-5-11-16-14(6-2)12-17(4)15-9-7-13(3)8-10-15;2*1-2/h5-6,11,13,15H,2,7-10,12H2,1,3-4H3;2*1-2H3/b11-5-,16-14+;;
InChIKeyRTEHZLGHHQJFRW-WJPLZXOPSA-N
MW294.53 g/mol
LogP5.71
Rot. Bonds5

About N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane

N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane (PubChem CID 144654671) has the molecular formula C19H38N2 and a molecular weight of 294.53 g/mol. Its IUPAC name is N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane.

Molecular Properties

Compound NameN,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane
PubChem CID144654671
Molecular FormulaC19H38N2
Molecular Weight294.53 g/mol
Exact Mass294.30
IUPAC NameN,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane
SMILESC=C/C(CN(C)C1CCC(C)CC1)=N\C=C/C.CC.CC
InChIInChI=1S/C15H26N2.2C2H6/c1-5-11-16-14(6-2)12-17(4)15-9-7-13(3)8-10-15;2*1-2/h5-6,11,13,15H,2,7-10,12H2,1,3-4H3;2*1-2H3/b11-5-,16-14+;;
InChIKeyRTEHZLGHHQJFRW-WJPLZXOPSA-N
XLogP5.71
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500294.53
LogP ≤ 55.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane with MolForge

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Related Compounds

N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine
CID 144654672
4-ethyl-N-methyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine
CID 144654682
ethane;3-[(Z)-prop-1-enyl]iminopent-4-enal
CID 170724337
N,4-dimethyl-N-(2-methylhexa-2,4-dienyl)cyclohexan-1-amine
CID 123153448
2-[methyl-(4-methylcyclohexyl)amino]acetic acid
CID 60712035
N'-methyl-N'-(4-methylcyclohexyl)-N-prop-2-enylethane-1,2-diamine
CID 62556852
[cyclopropyl(methyl)amino]methanol
CID 89240777
3-methyl-1-[methyl-(4-methylcyclohexyl)amino]butan-2-one
CID 79396284
butyl 2-[methyl-(4-methylcyclohexyl)amino]acetate
CID 54940545
N-(cyclopropylcarbamoyl)-2-[methyl-(4-methylcyclohexyl)amino]acetamide
CID 47113229
N-[(3E)-3-[(ethylideneamino)methylidene]pent-4-en-2-yl]-N,4-dimethylcyclohexan-1-amine
CID 144654680
ethane;methylcyclopentane;prop-1-ene
CID 142437781

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane?
The IUPAC name of N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane (CID 144654671) is N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane.
What is the SMILES notation for N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane?
The canonical SMILES for N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane is C=C/C(CN(C)C1CCC(C)CC1)=N\C=C/C.CC.CC.
What is the InChIKey of N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane?
The InChIKey is RTEHZLGHHQJFRW-WJPLZXOPSA-N. The full InChI is InChI=1S/C15H26N2.2C2H6/c1-5-11-16-14(6-2)12-17(4)15-9-7-13(3)8-10-15;2*1-2/h5-6,11,13,15H,2,7-10,12H2,1,3-4H3;2*1-2H3/b11-5-,16-14+;;.
What are the key properties of N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane?
N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane has a molecular weight of 294.53 g/mol, XLogP of 5.71, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-N-[2-[(Z)-prop-1-enyl]iminobut-3-enyl]cyclohexan-1-amine;ethane is sourced from PubChem (CID 144654671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).