N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine

C18H31N — CID 63523122

IUPACN-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine
SMILESCC(C)CNCC(CCCc1ccccc1)C(C)C
InChIInChI=1S/C18H31N/c1-15(2)13-19-14-18(16(3)4)12-8-11-17-9-6-5-7-10-17/h5-7,9-10,15-16,18-19H,8,11-14H2,1-4H3
InChIKeyQUEDWKXEITWOHX-UHFFFAOYSA-N
MW261.45 g/mol
LogP4.53
Rot. Bonds9

About N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine

N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine (PubChem CID 63523122) has the molecular formula C18H31N and a molecular weight of 261.45 g/mol. Its IUPAC name is N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine.

Molecular Properties

Compound NameN-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine
PubChem CID63523122
Molecular FormulaC18H31N
Molecular Weight261.45 g/mol
Exact Mass261.25
IUPAC NameN-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine
SMILESCC(C)CNCC(CCCc1ccccc1)C(C)C
InChIInChI=1S/C18H31N/c1-15(2)13-19-14-18(16(3)4)12-8-11-17-9-6-5-7-10-17/h5-7,9-10,15-16,18-19H,8,11-14H2,1-4H3
InChIKeyQUEDWKXEITWOHX-UHFFFAOYSA-N
XLogP4.53
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.45
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-phenyl-2-propan-2-yl-N-propylpentan-1-amine
CID 63522931
2-tert-butyl-N-(2-methylpropyl)-5-phenylpentan-1-amine
CID 83139154
N-benzyl-2-methyl-5-phenylpentan-1-amine
CID 19048188
N-(5-phenylpentan-2-yl)aniline
CID 134967933
2-methyl-N-[3-(4-phenylphenyl)propyl]propan-1-amine
CID 65454764
2-benzyl-N-(2-methylpropyl)-3-phenylpropan-1-amine
CID 63496022
N-benzyl-2-methylpropan-1-amine;ethane
CID 142079167
N,3-dimethyl-6-phenylhexan-2-amine
CID 61485141
2-methyl-1-(2-methylpropylamino)-4-phenylbutan-2-ol
CID 62774344
2-tert-butyl-5-phenyl-N-propan-2-ylpentan-1-amine
CID 83138928
[(2R)-5-phenylpentan-2-yl]benzene
CID 143889057
2-chloro-N-(3-phenylpropyl)propan-1-amine
CID 65024000

Frequently Asked Questions

What is the IUPAC name of N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine?
The IUPAC name of N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine (CID 63523122) is N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine.
What is the SMILES notation for N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine?
The canonical SMILES for N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine is CC(C)CNCC(CCCc1ccccc1)C(C)C.
What is the InChIKey of N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine?
The InChIKey is QUEDWKXEITWOHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H31N/c1-15(2)13-19-14-18(16(3)4)12-8-11-17-9-6-5-7-10-17/h5-7,9-10,15-16,18-19H,8,11-14H2,1-4H3.
What are the key properties of N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine?
N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine has a molecular weight of 261.45 g/mol, XLogP of 4.53, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylpropyl)-5-phenyl-2-propan-2-ylpentan-1-amine is sourced from PubChem (CID 63523122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).