4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine

C19H34N2 — CID 79060132

IUPAC4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine
SMILESCCN(CC)C(CC)(CC)C(CCc1ccccc1)NC
InChIInChI=1S/C19H34N2/c1-6-19(7-2,21(8-3)9-4)18(20-5)16-15-17-13-11-10-12-14-17/h10-14,18,20H,6-9,15-16H2,1-5H3
InChIKeyHZNQFAAUIKKGMH-UHFFFAOYSA-N
MW290.50 g/mol
LogP4.11
Rot. Bonds10

About 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine

4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine (PubChem CID 79060132) has the molecular formula C19H34N2 and a molecular weight of 290.50 g/mol. Its IUPAC name is 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine.

Molecular Properties

Compound Name4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine
PubChem CID79060132
Molecular FormulaC19H34N2
Molecular Weight290.50 g/mol
Exact Mass290.27
IUPAC Name4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine
SMILESCCN(CC)C(CC)(CC)C(CCc1ccccc1)NC
InChIInChI=1S/C19H34N2/c1-6-19(7-2,21(8-3)9-4)18(20-5)16-15-17-13-11-10-12-14-17/h10-14,18,20H,6-9,15-16H2,1-5H3
InChIKeyHZNQFAAUIKKGMH-UHFFFAOYSA-N
XLogP4.11
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.50
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-ethoxy-N,4-dimethyl-1-phenylhexan-3-amine
CID 116758710
5-[1-(methylamino)-3-phenylpropyl]nonan-5-ol
CID 139814433
4-ethyl-4-N,4-N-dimethyl-1-phenyl-3-N-propylhexane-3,4-diamine
CID 79059352
N-methyl-1,5-diphenylpentan-3-amine
CID 10586995
N,N-diethyl-4-hydrazinyl-3-methyl-7-phenylheptan-3-amine
CID 105240772
3-N,3-N,3-triethyl-1-(5-ethylthiophen-2-yl)-2-N-methylpentane-2,3-diamine
CID 79060124
3-N,3-N,3-triethyl-4-N-methylnon-8-ene-3,4-diamine
CID 79068358
N,N-diethyl-4-phenylbutan-2-amine
CID 567866
(1R)-1-(methylamino)-3-phenylpropan-1-ol
CID 67675162
(3R)-N-methyl-5-phenylpent-1-en-3-amine
CID 124509710
2-N,2-N,2-trimethyl-5-phenyl-3-N-propylpentane-2,3-diamine
CID 79054320
CID 59877545
CID 59877545

Frequently Asked Questions

What is the IUPAC name of 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine?
The IUPAC name of 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine (CID 79060132) is 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine.
What is the SMILES notation for 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine?
The canonical SMILES for 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine is CCN(CC)C(CC)(CC)C(CCc1ccccc1)NC.
What is the InChIKey of 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine?
The InChIKey is HZNQFAAUIKKGMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H34N2/c1-6-19(7-2,21(8-3)9-4)18(20-5)16-15-17-13-11-10-12-14-17/h10-14,18,20H,6-9,15-16H2,1-5H3.
What are the key properties of 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine?
4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine has a molecular weight of 290.50 g/mol, XLogP of 4.11, 10 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N,4-triethyl-3-N-methyl-1-phenylhexane-3,4-diamine is sourced from PubChem (CID 79060132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).