N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine

C11H21N — CID 156859544

IUPACN-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine
SMILESC=CN(/C=C\C)CCC(C)(C)C
InChIInChI=1S/C11H21N/c1-6-9-12(7-2)10-8-11(3,4)5/h6-7,9H,2,8,10H2,1,3-5H3/b9-6-
InChIKeyUOWCBDCWPXCECF-TWGQIWQCSA-N
MW167.30 g/mol
LogP3.40
Rot. Bonds4

About N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine

N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine (PubChem CID 156859544) has the molecular formula C11H21N and a molecular weight of 167.30 g/mol. Its IUPAC name is N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine.

Molecular Properties

Compound NameN-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine
PubChem CID156859544
Molecular FormulaC11H21N
Molecular Weight167.30 g/mol
Exact Mass167.17
IUPAC NameN-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine
SMILESC=CN(/C=C\C)CCC(C)(C)C
InChIInChI=1S/C11H21N/c1-6-9-12(7-2)10-8-11(3,4)5/h6-7,9H,2,8,10H2,1,3-5H3/b9-6-
InChIKeyUOWCBDCWPXCECF-TWGQIWQCSA-N
XLogP3.40
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.30
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-tert-butyl-N-ethenyl-3,3-dimethylbutan-1-amine
CID 144774483
N-[(Z)-prop-1-enyl]-N-[(E)-prop-1-enyl]propan-1-amine
CID 45087803
N-but-3-enyl-N-ethyl-3,3-dimethylbutan-1-amine
CID 89010873
2,2-dimethylhexane;tris(prop-1-ene)
CID 160899116
N,N-dihydroxy-3,3-dimethylbutan-1-amine
CID 118571145
N-ethenyl-N-methylprop-1-en-1-amine
CID 72587772
(E)-N-ethenyl-N-methylprop-1-en-1-amine
CID 18732256
N-ethenyl-N,3,3-trimethylpentan-1-amine
CID 167016680
N,N,N',N'-tetrakis(ethenyl)butane-1,4-diamine
CID 149434402
N,3,3-trimethyl-N-[methyl(dimethylidene)-λ6-sulfanyl]butan-1-amine
CID 143354901
[3,3-dimethylbutyl(methyl)amino]methanethiol
CID 115228352
6,6-dimethyl-3-methylidenehept-1-ene
CID 153290519

Frequently Asked Questions

What is the IUPAC name of N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine?
The IUPAC name of N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine (CID 156859544) is N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine.
What is the SMILES notation for N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine?
The canonical SMILES for N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine is C=CN(/C=C\C)CCC(C)(C)C.
What is the InChIKey of N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine?
The InChIKey is UOWCBDCWPXCECF-TWGQIWQCSA-N. The full InChI is InChI=1S/C11H21N/c1-6-9-12(7-2)10-8-11(3,4)5/h6-7,9H,2,8,10H2,1,3-5H3/b9-6-.
What are the key properties of N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine?
N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine has a molecular weight of 167.30 g/mol, XLogP of 3.40, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethenyl-3,3-dimethyl-N-[(Z)-prop-1-enyl]butan-1-amine is sourced from PubChem (CID 156859544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).