2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine

C10H22N2 — CID 144707710

IUPAC2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine
SMILESC=C(NC(C)CC)C(N)C(C)C
InChIInChI=1S/C10H22N2/c1-6-8(4)12-9(5)10(11)7(2)3/h7-8,10,12H,5-6,11H2,1-4H3
InChIKeyUXBLTFUZQDYSAA-UHFFFAOYSA-N
MW170.30 g/mol
LogP1.87
Rot. Bonds5

About 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine

2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine (PubChem CID 144707710) has the molecular formula C10H22N2 and a molecular weight of 170.30 g/mol. Its IUPAC name is 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine.

Molecular Properties

Compound Name2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine
PubChem CID144707710
Molecular FormulaC10H22N2
Molecular Weight170.30 g/mol
Exact Mass170.18
IUPAC Name2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine
SMILESC=C(NC(C)CC)C(N)C(C)C
InChIInChI=1S/C10H22N2/c1-6-8(4)12-9(5)10(11)7(2)3/h7-8,10,12H,5-6,11H2,1-4H3
InChIKeyUXBLTFUZQDYSAA-UHFFFAOYSA-N
XLogP1.87
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.30
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

(2R,3R)-2-amino-N-[(2S)-butan-2-yl]-3-methylpentanamide
CID 93001596
[amino-(butan-2-ylamino)methylidene]-methylideneazanium
CID 163802497
N-[(2R)-butan-2-yl]-2-methylbutanamide
CID 88542995
3-amino-N-[(2S)-butan-2-yl]butanamide
CID 142118681
1,3-di(butan-2-yl)thiourea
CID 5366322
N'-[(2R)-butan-2-yl]oxamide
CID 124605597
(2S)-2-amino-3-methyl-N-pentan-2-ylbutanamide
CID 61148058
2-amino-N-[1-(butan-2-ylamino)-1-oxopropan-2-yl]-3-methylpentanamide
CID 119756305
3-(3,3-diaminoprop-1-en-2-ylamino)butanal
CID 135130114
N-butan-2-ylcarbamoyl iodide
CID 118554163
3-amino-N-butan-2-ylpropanamide
CID 16784988
calcium;N-butan-2-ylcarbamothioate;carbamothioate
CID 118002354

Frequently Asked Questions

What is the IUPAC name of 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine?
The IUPAC name of 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine (CID 144707710) is 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine.
What is the SMILES notation for 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine?
The canonical SMILES for 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine is C=C(NC(C)CC)C(N)C(C)C.
What is the InChIKey of 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine?
The InChIKey is UXBLTFUZQDYSAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2/c1-6-8(4)12-9(5)10(11)7(2)3/h7-8,10,12H,5-6,11H2,1-4H3.
What are the key properties of 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine?
2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine has a molecular weight of 170.30 g/mol, XLogP of 1.87, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-butan-2-yl-4-methylpent-1-ene-2,3-diamine is sourced from PubChem (CID 144707710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).