N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide

C12H25N3O — CID 115356303

IUPACN-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide
SMILESCC(C)(C)NC(=O)CNCC1CCNCC1
InChIInChI=1S/C12H25N3O/c1-12(2,3)15-11(16)9-14-8-10-4-6-13-7-5-10/h10,13-14H,4-9H2,1-3H3,(H,15,16)
InChIKeyOEGRSQIJQMAUFL-UHFFFAOYSA-N
MW227.35 g/mol
LogP0.49
Rot. Bonds4

About N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide

N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide (PubChem CID 115356303) has the molecular formula C12H25N3O and a molecular weight of 227.35 g/mol. Its IUPAC name is N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide
PubChem CID115356303
Molecular FormulaC12H25N3O
Molecular Weight227.35 g/mol
Exact Mass227.20
IUPAC NameN-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide
SMILESCC(C)(C)NC(=O)CNCC1CCNCC1
InChIInChI=1S/C12H25N3O/c1-12(2,3)15-11(16)9-14-8-10-4-6-13-7-5-10/h10,13-14H,4-9H2,1-3H3,(H,15,16)
InChIKeyOEGRSQIJQMAUFL-UHFFFAOYSA-N
XLogP0.49
TPSA53.16 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.35
LogP ≤ 50.49
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-2-(piperidin-4-ylmethylamino)acetamide
CID 79708074
1-tert-butyl-3-(piperidin-4-ylmethyl)urea
CID 28786559
N-tert-butyl-2-[(2-piperidin-4-ylsulfanylacetyl)amino]acetamide
CID 114626598
N-tert-butyl-2-(2-piperidin-4-ylethylsulfonylamino)acetamide
CID 115356414
N-tert-butyl-2-[(1-methylpyrrolidin-3-yl)methylamino]acetamide
CID 60856288
2-(piperidin-4-ylmethylamino)acetic acid
CID 67168932
N-tert-butyl-2-[(3-hydroxycyclohexyl)methylamino]acetamide
CID 114147779
2-(cyclopropylmethylamino)-N-(1-hydroxy-2-methylpropan-2-yl)acetamide
CID 60841585
2-(cyclopropylmethylamino)-N-(3-methylpentan-3-yl)acetamide;hydrochloride
CID 119785992
N-tert-butyl-4-(piperidin-4-ylmethyl)piperazine-1-carboxamide
CID 120849271
2-(cyclopentylmethylamino)-N-(2-methylbutan-2-yl)acetamide
CID 61486055
N-tert-butyl-4-(piperidin-4-ylmethyl)piperazine-1-carboxamide;hydrochloride
CID 120849270

Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide?
The IUPAC name of N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide (CID 115356303) is N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide.
What is the SMILES notation for N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide?
The canonical SMILES for N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide is CC(C)(C)NC(=O)CNCC1CCNCC1.
What is the InChIKey of N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide?
The InChIKey is OEGRSQIJQMAUFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3O/c1-12(2,3)15-11(16)9-14-8-10-4-6-13-7-5-10/h10,13-14H,4-9H2,1-3H3,(H,15,16).
What are the key properties of N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide?
N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide has a molecular weight of 227.35 g/mol, XLogP of 0.49, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(piperidin-4-ylmethylamino)acetamide is sourced from PubChem (CID 115356303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).