2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide

C16H31N3O2 — CID 119898185

IUPAC2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
SMILESCC(C)OCCN1CCC(NC(=O)CNCC2CC2)CC1
InChIInChI=1S/C16H31N3O2/c1-13(2)21-10-9-19-7-5-15(6-8-19)18-16(20)12-17-11-14-3-4-14/h13-15,17H,3-12H2,1-2H3,(H,18,20)
InChIKeyHGFJAPFCBGJQTN-UHFFFAOYSA-N
MW297.44 g/mol
LogP0.99
Rot. Bonds9

About 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide

2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide (PubChem CID 119898185) has the molecular formula C16H31N3O2 and a molecular weight of 297.44 g/mol. Its IUPAC name is 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
PubChem CID119898185
Molecular FormulaC16H31N3O2
Molecular Weight297.44 g/mol
Exact Mass297.24
IUPAC Name2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
SMILESCC(C)OCCN1CCC(NC(=O)CNCC2CC2)CC1
InChIInChI=1S/C16H31N3O2/c1-13(2)21-10-9-19-7-5-15(6-8-19)18-16(20)12-17-11-14-3-4-14/h13-15,17H,3-12H2,1-2H3,(H,18,20)
InChIKeyHGFJAPFCBGJQTN-UHFFFAOYSA-N
XLogP0.99
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.44
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]propanamide
CID 119898215
2-(cyclopropylmethylamino)-N-(1-ethylpiperidin-4-yl)acetamide
CID 54917428
N-cyclopropyl-2-(2-propan-2-yloxyethylamino)acetamide
CID 60697253
N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]-2-thiomorpholin-3-ylacetamide
CID 119942509
(2S)-N-cyclopropyl-2-hydroxy-2-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide
CID 129490273
N-methyl-1-(2-propan-2-yloxyethyl)piperidin-4-amine;hydrochloride
CID 119923511
N-[[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methyl]propan-1-amine
CID 62592739
N-[1-(2-amino-2-oxoethyl)piperidin-4-yl]-2-(cyclopropylmethylamino)acetamide
CID 60868376
N-(1-methylpiperidin-4-yl)-3-propan-2-yloxypropanamide
CID 142467334
4-(methoxymethyl)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]piperidine-4-carboxamide
CID 120647651
2-(cyclopropylmethylamino)-N-[1-(2-phenylethyl)piperidin-4-yl]acetamide;dihydrochloride
CID 119844580
N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]methanesulfonamide
CID 47134700

Frequently Asked Questions

What is the IUPAC name of 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide (CID 119898185) is 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide is CC(C)OCCN1CCC(NC(=O)CNCC2CC2)CC1.
What is the InChIKey of 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide?
The InChIKey is HGFJAPFCBGJQTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O2/c1-13(2)21-10-9-19-7-5-15(6-8-19)18-16(20)12-17-11-14-3-4-14/h13-15,17H,3-12H2,1-2H3,(H,18,20).
What are the key properties of 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide?
2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide has a molecular weight of 297.44 g/mol, XLogP of 0.99, 9 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclopropylmethylamino)-N-[1-(2-propan-2-yloxyethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 119898185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).