2,3-dimethyl-1-(methylideneamino)pentan-1-amine

C8H18N2 — CID 91477509

IUPAC2,3-dimethyl-1-(methylideneamino)pentan-1-amine
SMILESC=NC(N)C(C)C(C)CC
InChIInChI=1S/C8H18N2/c1-5-6(2)7(3)8(9)10-4/h6-8H,4-5,9H2,1-3H3
InChIKeyBTWDPAISPLRENU-UHFFFAOYSA-N
MW142.25 g/mol
LogP1.65
Rot. Bonds4

About 2,3-dimethyl-1-(methylideneamino)pentan-1-amine

2,3-dimethyl-1-(methylideneamino)pentan-1-amine (PubChem CID 91477509) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 2,3-dimethyl-1-(methylideneamino)pentan-1-amine.

Molecular Properties

Compound Name2,3-dimethyl-1-(methylideneamino)pentan-1-amine
PubChem CID91477509
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name2,3-dimethyl-1-(methylideneamino)pentan-1-amine
SMILESC=NC(N)C(C)C(C)CC
InChIInChI=1S/C8H18N2/c1-5-6(2)7(3)8(9)10-4/h6-8H,4-5,9H2,1-3H3
InChIKeyBTWDPAISPLRENU-UHFFFAOYSA-N
XLogP1.65
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

(3R)-4,5-dimethylheptan-3-amine
CID 163978078
3,4,5,6,7,8,9,10,11,12,13,14,15-tridecamethylheptadecane
CID 168768999
2-(methylideneamino)pentan-3-amine
CID 147607794
(4S)-2,3,4-trimethylhexane
CID 58359072
(3R,4R,5R,6S)-3,6-dimethyloctane-4,5-diamine
CID 101057431
1,1,1-trifluoro-3,4-dimethylhexan-2-amine
CID 163739387
(3R)-2,3-dimethylpentane;ethane;ethene
CID 178131669
2-amino-3,4-dimethylhexanamide
CID 131230677
(2S,3S)-2-amino-3-methylpentanoyl isocyanate
CID 141356203
2,3,5,6-tetramethyloctane-4-thiol
CID 139387047
ethane;3,4,5,6,7,8,9,10,11-nonamethyltridecane;sulfane;3,4,5,6-tetramethyloctane;tungsten
CID 162191243
(4R)-2,4-dimethylhexan-3-amine
CID 59252919

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethyl-1-(methylideneamino)pentan-1-amine?
The IUPAC name of 2,3-dimethyl-1-(methylideneamino)pentan-1-amine (CID 91477509) is 2,3-dimethyl-1-(methylideneamino)pentan-1-amine.
What is the SMILES notation for 2,3-dimethyl-1-(methylideneamino)pentan-1-amine?
The canonical SMILES for 2,3-dimethyl-1-(methylideneamino)pentan-1-amine is C=NC(N)C(C)C(C)CC.
What is the InChIKey of 2,3-dimethyl-1-(methylideneamino)pentan-1-amine?
The InChIKey is BTWDPAISPLRENU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-5-6(2)7(3)8(9)10-4/h6-8H,4-5,9H2,1-3H3.
What are the key properties of 2,3-dimethyl-1-(methylideneamino)pentan-1-amine?
2,3-dimethyl-1-(methylideneamino)pentan-1-amine has a molecular weight of 142.25 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethyl-1-(methylideneamino)pentan-1-amine is sourced from PubChem (CID 91477509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).