N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine

C10H24N2 — CID 115303228

IUPACN,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine
SMILESCCC(CC)NCC(C)CNC
InChIInChI=1S/C10H24N2/c1-5-10(6-2)12-8-9(3)7-11-4/h9-12H,5-8H2,1-4H3
InChIKeyFZDOAXMDHYSJFW-UHFFFAOYSA-N
MW172.32 g/mol
LogP1.62
Rot. Bonds7

About N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine

N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine (PubChem CID 115303228) has the molecular formula C10H24N2 and a molecular weight of 172.32 g/mol. Its IUPAC name is N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine
PubChem CID115303228
Molecular FormulaC10H24N2
Molecular Weight172.32 g/mol
Exact Mass172.19
IUPAC NameN,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine
SMILESCCC(CC)NCC(C)CNC
InChIInChI=1S/C10H24N2/c1-5-10(6-2)12-8-9(3)7-11-4/h9-12H,5-8H2,1-4H3
InChIKeyFZDOAXMDHYSJFW-UHFFFAOYSA-N
XLogP1.62
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.32
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-methyl-N-pentan-3-ylpentan-1-amine
CID 43204323
3-methyl-N-pentan-3-yl-2-propan-2-ylbutan-1-amine
CID 102904025
N-heptan-2-yl-N',2-dimethylpropane-1,3-diamine
CID 79201836
2-methyl-N-(1-methylsulfanylbutan-2-yl)butan-1-amine
CID 115899950
3-methyl-1-(pentan-3-ylamino)butan-2-ol
CID 115720488
2-N,2-N-dimethyl-1-N-pentan-3-ylbutane-1,2-diamine
CID 115714146
2-(2-methylbutylamino)propane-1,3-diol
CID 65312864
2,6-dimethyl-N-(2-methylbutyl)heptan-4-amine
CID 63477692
2-methyl-N-[2-methyl-3-(methylamino)propyl]butanamide
CID 81478398
N-(2-propan-2-ylsulfanylpropyl)pentan-3-amine
CID 62579088
(2R)-2-methyl-N-propan-2-ylbutan-1-amine
CID 28610226
2-methyl-3-(methylamino)propan-1-ol
CID 23264324

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine?
The IUPAC name of N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine (CID 115303228) is N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine.
What is the SMILES notation for N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine?
The canonical SMILES for N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine is CCC(CC)NCC(C)CNC.
What is the InChIKey of N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine?
The InChIKey is FZDOAXMDHYSJFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2/c1-5-10(6-2)12-8-9(3)7-11-4/h9-12H,5-8H2,1-4H3.
What are the key properties of N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine?
N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine has a molecular weight of 172.32 g/mol, XLogP of 1.62, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-N'-pentan-3-ylpropane-1,3-diamine is sourced from PubChem (CID 115303228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).