N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide

C12H22N2O — CID 106626540

IUPACN-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide
SMILESC=CC(=O)N(CC1CCCCN1)C(C)C
InChIInChI=1S/C12H22N2O/c1-4-12(15)14(10(2)3)9-11-7-5-6-8-13-11/h4,10-11,13H,1,5-9H2,2-3H3
InChIKeySRSXYLSYDOZYPN-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.55
Rot. Bonds4

About N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide

N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide (PubChem CID 106626540) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide.

Molecular Properties

Compound NameN-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide
PubChem CID106626540
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC NameN-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide
SMILESC=CC(=O)N(CC1CCCCN1)C(C)C
InChIInChI=1S/C12H22N2O/c1-4-12(15)14(10(2)3)9-11-7-5-6-8-13-11/h4,10-11,13H,1,5-9H2,2-3H3
InChIKeySRSXYLSYDOZYPN-UHFFFAOYSA-N
XLogP1.55
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)pent-4-enamide
CID 106609880
N-(piperidin-2-ylmethyl)-N-propan-2-ylbut-2-ynamide
CID 107990956
3-methyl-1-(piperidin-2-ylmethyl)-1-propan-2-ylurea
CID 106629717
4-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylpentanamide
CID 106626702
2-cyclopropyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylacetamide
CID 106626607
2-cyclohexyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylacetamide
CID 106626347
2-methoxy-N-(piperidin-2-ylmethyl)-N-propan-2-ylacetamide
CID 106626574
5-methyl-N-(piperidin-2-ylmethyl)-N-propan-2-yloxolane-2-carboxamide
CID 106626417
3,5-dimethyl-N-(piperidin-2-ylmethyl)-N-propan-2-ylbenzamide
CID 106626473
3-cyclopentyl-1-propan-2-yl-1-(pyrrolidin-2-ylmethyl)urea
CID 106613201
N-(piperidin-2-ylmethyl)-N-propan-2-ylmorpholine-4-carboxamide
CID 106629741
(E)-3-phenyl-N-propan-2-yl-N-(pyrrolidin-2-ylmethyl)prop-2-enamide
CID 106609856

Frequently Asked Questions

What is the IUPAC name of N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide?
The IUPAC name of N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide (CID 106626540) is N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide.
What is the SMILES notation for N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide?
The canonical SMILES for N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide is C=CC(=O)N(CC1CCCCN1)C(C)C.
What is the InChIKey of N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide?
The InChIKey is SRSXYLSYDOZYPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-4-12(15)14(10(2)3)9-11-7-5-6-8-13-11/h4,10-11,13H,1,5-9H2,2-3H3.
What are the key properties of N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide?
N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide has a molecular weight of 210.32 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(piperidin-2-ylmethyl)-N-propan-2-ylprop-2-enamide is sourced from PubChem (CID 106626540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).