N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine

C11H25N — CID 62530298

IUPACN,4-dimethyl-2-(2-methylpropyl)pentan-1-amine
SMILESCNCC(CC(C)C)CC(C)C
InChIInChI=1S/C11H25N/c1-9(2)6-11(8-12-5)7-10(3)4/h9-12H,6-8H2,1-5H3
InChIKeyIWEPRMBZUDBGCS-UHFFFAOYSA-N
MW171.33 g/mol
LogP2.91
Rot. Bonds6

About N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine

N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine (PubChem CID 62530298) has the molecular formula C11H25N and a molecular weight of 171.33 g/mol. Its IUPAC name is N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound NameN,4-dimethyl-2-(2-methylpropyl)pentan-1-amine
PubChem CID62530298
Molecular FormulaC11H25N
Molecular Weight171.33 g/mol
Exact Mass171.20
IUPAC NameN,4-dimethyl-2-(2-methylpropyl)pentan-1-amine
SMILESCNCC(CC(C)C)CC(C)C
InChIInChI=1S/C11H25N/c1-9(2)6-11(8-12-5)7-10(3)4/h9-12H,6-8H2,1-5H3
InChIKeyIWEPRMBZUDBGCS-UHFFFAOYSA-N
XLogP2.91
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.33
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N,4-dimethyl-2-(2-methylpropyl)heptan-1-amine
CID 62528910
N-methyl-2-(2-methylpropyl)nonan-1-amine
CID 63496028
(2S)-N,2,4-trimethylpentan-1-amine
CID 90327710
N,4-dimethyl-2-[2-(3-methylbutoxy)ethyl]pentan-1-amine
CID 62529508
N,4-dimethyl-2-[2-(2-methylpropoxy)ethyl]pentan-1-amine
CID 106456556
2-(2-ethoxyethyl)-N,4-dimethylpentan-1-amine
CID 62528504
ethane;N,2,4-trimethylpentan-1-amine
CID 142844862
2-benzyl-N,4-dimethylpentan-1-amine
CID 62529459
(3R)-5-methyl-3-(methylaminomethyl)-N-oxohexanamide
CID 144507791
2-iodo-N,4-dimethylpentan-1-amine
CID 155421161
N,4-dimethyl-2-(2-propylsulfonylethyl)pentan-1-amine
CID 106729640
2-[(4-iodophenyl)methyl]-N,4-dimethylpentan-1-amine
CID 65477138

Frequently Asked Questions

What is the IUPAC name of N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine?
The IUPAC name of N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine (CID 62530298) is N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine is CNCC(CC(C)C)CC(C)C.
What is the InChIKey of N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine?
The InChIKey is IWEPRMBZUDBGCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N/c1-9(2)6-11(8-12-5)7-10(3)4/h9-12H,6-8H2,1-5H3.
What are the key properties of N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine?
N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine has a molecular weight of 171.33 g/mol, XLogP of 2.91, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-2-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 62530298), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).