(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine

C10H17N — CID 142124132

IUPAC(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine
SMILESC=C(C)/C=C\C(=C)CN(C)C
InChIInChI=1S/C10H17N/c1-9(2)6-7-10(3)8-11(4)5/h6-7H,1,3,8H2,2,4-5H3/b7-6-
InChIKeyNYSXNAZSATWOFU-SREVYHEPSA-N
MW151.25 g/mol
LogP2.24
Rot. Bonds4

About (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine

(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine (PubChem CID 142124132) has the molecular formula C10H17N and a molecular weight of 151.25 g/mol. Its IUPAC name is (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine.

Molecular Properties

Compound Name(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine
PubChem CID142124132
Molecular FormulaC10H17N
Molecular Weight151.25 g/mol
Exact Mass151.14
IUPAC Name(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine
SMILESC=C(C)/C=C\C(=C)CN(C)C
InChIInChI=1S/C10H17N/c1-9(2)6-7-10(3)8-11(4)5/h6-7H,1,3,8H2,2,4-5H3/b7-6-
InChIKeyNYSXNAZSATWOFU-SREVYHEPSA-N
XLogP2.24
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.25
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-Methyl-4-vinyl-1,2,3,6-tetrahydro-pyridine
CID 10036134
Ferrocene, ((dimethylamino)methyl)-
CID 16211226
N,N-Diethyl-2-methylidenebut-3-en-1-amine
CID 14644961
o-Lithiodimethylbenzylamine
CID 10866427
2,6-Bis(dimethylaminomethyl)phenyllithium
CID 11830389
3-Ethyl-1-methyl-1,2-dihydropyridine
CID 12506166
5-ethyl-1-methyl-2H-pyridine
CID 12506167
N,N-dimethylamino-4-methyl-pentene-3
CID 12545385
2-Methylidene-N,N-dipropylbut-3-en-1-amine
CID 18512648
2-Diethylaminomethylphenyllithium
CID 21399648
1,3,5-Collidin
CID 22046103
2-[(Diethylamino)methyl]phenylmagnesium bromide, 0.25M in THF
CID 57533218

Frequently Asked Questions

What is the IUPAC name of (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine?
The IUPAC name of (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine (CID 142124132) is (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine.
What is the SMILES notation for (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine?
The canonical SMILES for (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine is C=C(C)/C=C\C(=C)CN(C)C.
What is the InChIKey of (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine?
The InChIKey is NYSXNAZSATWOFU-SREVYHEPSA-N. The full InChI is InChI=1S/C10H17N/c1-9(2)6-7-10(3)8-11(4)5/h6-7H,1,3,8H2,2,4-5H3/b7-6-.
What are the key properties of (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine?
(3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine has a molecular weight of 151.25 g/mol, XLogP of 2.24, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N,N,5-trimethyl-2-methylidenehexa-3,5-dien-1-amine is sourced from PubChem (CID 142124132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).