2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine

C10H25N3 — CID 138739407

IUPAC2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine
SMILESCC(C)C(C)(C)N(CN)C(C)(C)N
InChIInChI=1S/C10H25N3/c1-8(2)9(3,4)13(7-11)10(5,6)12/h8H,7,11-12H2,1-6H3
InChIKeyNVMLFSUBRKAHMM-UHFFFAOYSA-N
MW187.33 g/mol
LogP1.33
Rot. Bonds4

About 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine

2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine (PubChem CID 138739407) has the molecular formula C10H25N3 and a molecular weight of 187.33 g/mol. Its IUPAC name is 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine.

Molecular Properties

Compound Name2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine
PubChem CID138739407
Molecular FormulaC10H25N3
Molecular Weight187.33 g/mol
Exact Mass187.20
IUPAC Name2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine
SMILESCC(C)C(C)(C)N(CN)C(C)(C)N
InChIInChI=1S/C10H25N3/c1-8(2)9(3,4)13(7-11)10(5,6)12/h8H,7,11-12H2,1-6H3
InChIKeyNVMLFSUBRKAHMM-UHFFFAOYSA-N
XLogP1.33
TPSA55.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.33
LogP ≤ 51.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1-(2,3-dimethylbutan-2-yl)-1-methylhydrazine
CID 166768392
propane;N,N,2,3-tetramethylbutan-2-amine
CID 143946968
N,N-dimethylmethanamine;2,3,4-trimethylpentan-3-amine
CID 87751828
2-[bis(2-amino-3-methylbutan-2-yl)amino]ethanol
CID 87764605
2-(2,3-dimethylbutyl)-4,5-dimethylhexane-1,2-diamine
CID 126685858
1,4-diamino-4-methylpentane-2-thiol
CID 174430378
2-di(propan-2-yl)phosphanylpropan-2-yl-di(propan-2-yl)phosphane
CID 89346513
2,3,4-trimethylpentan-3-amine;hydrobromide
CID 18185119
3,3-difluoro-2-methylbutan-1-amine
CID 84647801
2,5,5-trimethyl-3-propan-2-ylhexan-3-amine
CID 167343931
(2R)-1-amino-2,3-dimethylbutan-2-ol
CID 51684116
ethanol;2,3,4-trimethylpentan-3-amine
CID 175160017

Frequently Asked Questions

What is the IUPAC name of 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine?
The IUPAC name of 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine (CID 138739407) is 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine.
What is the SMILES notation for 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine?
The canonical SMILES for 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine is CC(C)C(C)(C)N(CN)C(C)(C)N.
What is the InChIKey of 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine?
The InChIKey is NVMLFSUBRKAHMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25N3/c1-8(2)9(3,4)13(7-11)10(5,6)12/h8H,7,11-12H2,1-6H3.
What are the key properties of 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine?
2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine has a molecular weight of 187.33 g/mol, XLogP of 1.33, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N'-(aminomethyl)-2-N'-(2,3-dimethylbutan-2-yl)propane-2,2-diamine is sourced from PubChem (CID 138739407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).