4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine

C19H29N — CID 114474715

IUPAC4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine
SMILESC=C(C)CCC(NCCC)C1CCCc2ccccc21
InChIInChI=1S/C19H29N/c1-4-14-20-19(13-12-15(2)3)18-11-7-9-16-8-5-6-10-17(16)18/h5-6,8,10,18-20H,2,4,7,9,11-14H2,1,3H3
InChIKeyOVLMHXWXBBNKIZ-UHFFFAOYSA-N
MW271.45 g/mol
LogP4.83
Rot. Bonds7

About 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine

4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine (PubChem CID 114474715) has the molecular formula C19H29N and a molecular weight of 271.45 g/mol. Its IUPAC name is 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine.

Molecular Properties

Compound Name4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine
PubChem CID114474715
Molecular FormulaC19H29N
Molecular Weight271.45 g/mol
Exact Mass271.23
IUPAC Name4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine
SMILESC=C(C)CCC(NCCC)C1CCCc2ccccc21
InChIInChI=1S/C19H29N/c1-4-14-20-19(13-12-15(2)3)18-11-7-9-16-8-5-6-10-17(16)18/h5-6,8,10,18-20H,2,4,7,9,11-14H2,1,3H3
InChIKeyOVLMHXWXBBNKIZ-UHFFFAOYSA-N
XLogP4.83
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pentan-1-amine
CID 55188345
1-(2,3-dihydro-1H-inden-1-yl)-3-methylidene-N-propylpentan-1-amine
CID 66039008
2,2-dimethyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)propan-1-amine
CID 55188342
1-(2,3-dihydro-1H-inden-1-yl)-3-methyl-N-propylbutan-1-amine
CID 65403398
N-[cyclohexyl(1,2,3,4-tetrahydronaphthalen-1-yl)methyl]propan-1-amine
CID 63418251
1-(2,3-dihydro-1-benzofuran-2-yl)-4-methyl-N-propylpent-4-en-1-amine
CID 114475790
1-(2,3-dihydro-1H-inden-1-yl)-4-methylpent-4-en-1-ol
CID 114473913
1-(7-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl)-N-propylbutan-1-amine
CID 83050599
2-cyclopentyl-N-ethyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 63418635
N-ethyl-2-propoxy-1-(1,2,3,4-tetrahydronaphthalen-1-yl)ethanamine
CID 79575553
N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)butan-2-amine
CID 55241508
1-(1,2,3,4-tetrahydronaphthalen-1-yl)decan-1-amine
CID 63418547

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine?
The IUPAC name of 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine (CID 114474715) is 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine.
What is the SMILES notation for 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine?
The canonical SMILES for 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine is C=C(C)CCC(NCCC)C1CCCc2ccccc21.
What is the InChIKey of 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine?
The InChIKey is OVLMHXWXBBNKIZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N/c1-4-14-20-19(13-12-15(2)3)18-11-7-9-16-8-5-6-10-17(16)18/h5-6,8,10,18-20H,2,4,7,9,11-14H2,1,3H3.
What are the key properties of 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine?
4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine has a molecular weight of 271.45 g/mol, XLogP of 4.83, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-propyl-1-(1,2,3,4-tetrahydronaphthalen-1-yl)pent-4-en-1-amine is sourced from PubChem (CID 114474715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).