N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine

C19H31N — CID 82985313

IUPACN-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine
SMILESCCCC(CCC)C(NC)c1ccc2c(c1)CCCC2
InChIInChI=1S/C19H31N/c1-4-8-16(9-5-2)19(20-3)18-13-12-15-10-6-7-11-17(15)14-18/h12-14,16,19-20H,4-11H2,1-3H3
InChIKeyQLEUOCVPJMQNTP-UHFFFAOYSA-N
MW273.46 g/mol
LogP5.04
Rot. Bonds7

About N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine

N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine (PubChem CID 82985313) has the molecular formula C19H31N and a molecular weight of 273.46 g/mol. Its IUPAC name is N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine.

Molecular Properties

Compound NameN-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine
PubChem CID82985313
Molecular FormulaC19H31N
Molecular Weight273.46 g/mol
Exact Mass273.25
IUPAC NameN-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine
SMILESCCCC(CCC)C(NC)c1ccc2c(c1)CCCC2
InChIInChI=1S/C19H31N/c1-4-8-16(9-5-2)19(20-3)18-13-12-15-10-6-7-11-17(15)14-18/h12-14,16,19-20H,4-11H2,1-3H3
InChIKeyQLEUOCVPJMQNTP-UHFFFAOYSA-N
XLogP5.04
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500273.46
LogP ≤ 55.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,3-dihydro-1H-inden-5-yl)-N,2-dimethylpentan-1-amine
CID 43485099
N,N'-dimethyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)methanediamine
CID 116954289
1-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-amine
CID 43198216
1-(methylamino)-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-2-ol
CID 116859383
N-[1-(5,6,7,8-tetrahydronaphthalen-2-yl)ethyl]pentan-2-amine
CID 43108616
2-[2,3-dihydro-1H-inden-5-yl(methylamino)methyl]butanenitrile
CID 116960523
1-(2,3-dihydro-1H-inden-5-yl)-N,2-dimethylbutane-1,4-diamine
CID 116949561
1-(4-fluorophenyl)-N-methyl-2-propylpentan-1-amine
CID 82984028
N-methyl-2-methylsulfonyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)propan-1-amine
CID 104518447
2,2-dimethyl-N-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)butan-1-amine
CID 63502995
2-(2,3-dihydro-1H-inden-5-yl)pentanenitrile
CID 82076345
1-(3-ethylphenyl)-N-methyl-2-propylpentan-1-amine
CID 105018498

Frequently Asked Questions

What is the IUPAC name of N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine?
The IUPAC name of N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine (CID 82985313) is N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine.
What is the SMILES notation for N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine?
The canonical SMILES for N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine is CCCC(CCC)C(NC)c1ccc2c(c1)CCCC2.
What is the InChIKey of N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine?
The InChIKey is QLEUOCVPJMQNTP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H31N/c1-4-8-16(9-5-2)19(20-3)18-13-12-15-10-6-7-11-17(15)14-18/h12-14,16,19-20H,4-11H2,1-3H3.
What are the key properties of N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine?
N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine has a molecular weight of 273.46 g/mol, XLogP of 5.04, 7 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-propyl-1-(5,6,7,8-tetrahydronaphthalen-2-yl)pentan-1-amine is sourced from PubChem (CID 82985313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).