N-butan-2-yl-N-butylpropanimidamide

C11H24N2 — CID 63177436

IUPACN-butan-2-yl-N-butylpropanimidamide
SMILES[H]/N=C(\CC)N(CCCC)C(C)CC
InChIInChI=1S/C11H24N2/c1-5-8-9-13(10(4)6-2)11(12)7-3/h10,12H,5-9H2,1-4H3/b12-11+
InChIKeyUQSYVOXKQFSFRY-VAWYXSNFSA-N
MW184.33 g/mol
LogP3.27
Rot. Bonds6

About N-butan-2-yl-N-butylpropanimidamide

N-butan-2-yl-N-butylpropanimidamide (PubChem CID 63177436) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is N-butan-2-yl-N-butylpropanimidamide.

Molecular Properties

Compound NameN-butan-2-yl-N-butylpropanimidamide
PubChem CID63177436
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC NameN-butan-2-yl-N-butylpropanimidamide
SMILES[H]/N=C(\CC)N(CCCC)C(C)CC
InChIInChI=1S/C11H24N2/c1-5-8-9-13(10(4)6-2)11(12)7-3/h10,12H,5-9H2,1-4H3/b12-11+
InChIKeyUQSYVOXKQFSFRY-VAWYXSNFSA-N
XLogP3.27
TPSA27.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N,N-dibutylbutanimidamide
CID 63175446
5-bromo-N-butan-2-yl-N-butylpentanamide
CID 107909392
N-pentyl-N-propan-2-ylethanimidamide
CID 63173308
N-methyl-N-propylpropanimidamide
CID 63176074
N-butyl-N-ethylhexanimidamide;propane
CID 155716636
(2R)-2-amino-N-butan-2-yl-N-butyl-3-methylbutanamide
CID 79012967
2-bromo-N-butan-2-yl-N-butyl-3-methylbutanamide
CID 60948518
5-[butan-2-yl(butyl)amino]-5-oxopentanoic acid
CID 60662142
N-butan-2-yl-N-butyl-2-propan-2-yloxyacetamide
CID 112687224
N-ethenyl-N-propan-2-ylpropanimidamide
CID 146638834
(2S)-2-amino-N-butan-2-yl-N-butylpentanamide
CID 107568931
2-[[butan-2-yl(butyl)carbamoyl]amino]propanoic acid
CID 55004578

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-butylpropanimidamide?
The IUPAC name of N-butan-2-yl-N-butylpropanimidamide (CID 63177436) is N-butan-2-yl-N-butylpropanimidamide.
What is the SMILES notation for N-butan-2-yl-N-butylpropanimidamide?
The canonical SMILES for N-butan-2-yl-N-butylpropanimidamide is [H]/N=C(\CC)N(CCCC)C(C)CC.
What is the InChIKey of N-butan-2-yl-N-butylpropanimidamide?
The InChIKey is UQSYVOXKQFSFRY-VAWYXSNFSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-8-9-13(10(4)6-2)11(12)7-3/h10,12H,5-9H2,1-4H3/b12-11+.
What are the key properties of N-butan-2-yl-N-butylpropanimidamide?
N-butan-2-yl-N-butylpropanimidamide has a molecular weight of 184.33 g/mol, XLogP of 3.27, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-butylpropanimidamide is sourced from PubChem (CID 63177436), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).