3-(tert-butylamino)-2-methylidenepentanamide

C10H20N2O — CID 18679984

IUPAC3-(tert-butylamino)-2-methylidenepentanamide
SMILESC=C(C(N)=O)C(CC)NC(C)(C)C
InChIInChI=1S/C10H20N2O/c1-6-8(7(2)9(11)13)12-10(3,4)5/h8,12H,2,6H2,1,3-5H3,(H2,11,13)
InChIKeyUPTZCKNNAADBMF-UHFFFAOYSA-N
MW184.28 g/mol
LogP1.19
Rot. Bonds4

About 3-(tert-butylamino)-2-methylidenepentanamide

3-(tert-butylamino)-2-methylidenepentanamide (PubChem CID 18679984) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-(tert-butylamino)-2-methylidenepentanamide.

Molecular Properties

Compound Name3-(tert-butylamino)-2-methylidenepentanamide
PubChem CID18679984
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name3-(tert-butylamino)-2-methylidenepentanamide
SMILESC=C(C(N)=O)C(CC)NC(C)(C)C
InChIInChI=1S/C10H20N2O/c1-6-8(7(2)9(11)13)12-10(3,4)5/h8,12H,2,6H2,1,3-5H3,(H2,11,13)
InChIKeyUPTZCKNNAADBMF-UHFFFAOYSA-N
XLogP1.19
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(tert-butylamino)-2-methylidenepentanamide?
The IUPAC name of 3-(tert-butylamino)-2-methylidenepentanamide (CID 18679984) is 3-(tert-butylamino)-2-methylidenepentanamide.
What is the SMILES notation for 3-(tert-butylamino)-2-methylidenepentanamide?
The canonical SMILES for 3-(tert-butylamino)-2-methylidenepentanamide is C=C(C(N)=O)C(CC)NC(C)(C)C.
What is the InChIKey of 3-(tert-butylamino)-2-methylidenepentanamide?
The InChIKey is UPTZCKNNAADBMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c1-6-8(7(2)9(11)13)12-10(3,4)5/h8,12H,2,6H2,1,3-5H3,(H2,11,13).
What are the key properties of 3-(tert-butylamino)-2-methylidenepentanamide?
3-(tert-butylamino)-2-methylidenepentanamide has a molecular weight of 184.28 g/mol, XLogP of 1.19, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(tert-butylamino)-2-methylidenepentanamide is sourced from PubChem (CID 18679984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).