4-methyl-N-(2-methylpropyl)pentan-1-amine

C10H23N — CID 54104955

IUPAC4-methyl-N-(2-methylpropyl)pentan-1-amine
SMILESCC(C)CCCNCC(C)C
InChIInChI=1S/C10H23N/c1-9(2)6-5-7-11-8-10(3)4/h9-11H,5-8H2,1-4H3
InChIKeyCKRYWBQVVGZNKR-UHFFFAOYSA-N
MW157.30 g/mol
LogP2.67
Rot. Bonds6

About 4-methyl-N-(2-methylpropyl)pentan-1-amine

4-methyl-N-(2-methylpropyl)pentan-1-amine (PubChem CID 54104955) has the molecular formula C10H23N and a molecular weight of 157.30 g/mol. Its IUPAC name is 4-methyl-N-(2-methylpropyl)pentan-1-amine.

Molecular Properties

Compound Name4-methyl-N-(2-methylpropyl)pentan-1-amine
PubChem CID54104955
Molecular FormulaC10H23N
Molecular Weight157.30 g/mol
Exact Mass157.18
IUPAC Name4-methyl-N-(2-methylpropyl)pentan-1-amine
SMILESCC(C)CCCNCC(C)C
InChIInChI=1S/C10H23N/c1-9(2)6-5-7-11-8-10(3)4/h9-11H,5-8H2,1-4H3
InChIKeyCKRYWBQVVGZNKR-UHFFFAOYSA-N
XLogP2.67
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-iodo-N-(2-methylpropyl)pentan-1-amine
CID 155459836
4-(4-methylpentoxy)-N-(2-methylpropyl)butan-1-amine
CID 62456980
2-methyl-N-[3-[3-(4-methylpentoxy)propoxy]propyl]propan-1-amine;molecular hydrogen
CID 158253210
N-ethyl-N'-(2-methylpropyl)propane-1,3-diamine
CID 55209612
N,N'-bis[2-(2-methylpropylamino)ethyl]ethane-1,2-diamine
CID 54452976
10-methyl-N-(10-methylundecyl)undecan-1-amine
CID 22625170
11-methyl-N-(6-methylheptyl)dodecan-1-amine
CID 175343740
4-N-butan-2-yl-4-N-methyl-1-N-(2-methylpropyl)pentane-1,4-diamine
CID 62419355
2-methyl-N-[2-(4-methylpentoxy)ethyl]propan-1-amine;molecular hydrogen
CID 157169252
N-ethyl-N'-[3-[3-(2-methylpropylamino)propylamino]propyl]propane-1,3-diamine
CID 58965211
N-(2-iodoethyl)-4-methylpentan-1-amine
CID 114505662
N-(2-fluoroethyl)-4-methylpentan-1-amine
CID 80695827

Frequently Asked Questions

What is the IUPAC name of 4-methyl-N-(2-methylpropyl)pentan-1-amine?
The IUPAC name of 4-methyl-N-(2-methylpropyl)pentan-1-amine (CID 54104955) is 4-methyl-N-(2-methylpropyl)pentan-1-amine.
What is the SMILES notation for 4-methyl-N-(2-methylpropyl)pentan-1-amine?
The canonical SMILES for 4-methyl-N-(2-methylpropyl)pentan-1-amine is CC(C)CCCNCC(C)C.
What is the InChIKey of 4-methyl-N-(2-methylpropyl)pentan-1-amine?
The InChIKey is CKRYWBQVVGZNKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23N/c1-9(2)6-5-7-11-8-10(3)4/h9-11H,5-8H2,1-4H3.
What are the key properties of 4-methyl-N-(2-methylpropyl)pentan-1-amine?
4-methyl-N-(2-methylpropyl)pentan-1-amine has a molecular weight of 157.30 g/mol, XLogP of 2.67, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-N-(2-methylpropyl)pentan-1-amine is sourced from PubChem (CID 54104955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).