N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide

C13H22N4O2 — CID 63902997

IUPACN-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide
SMILESCn1ccnc1CNC(=O)CCOC1CCNCC1
InChIInChI=1S/C13H22N4O2/c1-17-8-7-15-12(17)10-16-13(18)4-9-19-11-2-5-14-6-3-11/h7-8,11,14H,2-6,9-10H2,1H3,(H,16,18)
InChIKeyQROJZLUCOZCZAP-UHFFFAOYSA-N
MW266.34 g/mol
LogP0.19
Rot. Bonds6

About N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide

N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide (PubChem CID 63902997) has the molecular formula C13H22N4O2 and a molecular weight of 266.34 g/mol. Its IUPAC name is N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide.

Molecular Properties

Compound NameN-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide
PubChem CID63902997
Molecular FormulaC13H22N4O2
Molecular Weight266.34 g/mol
Exact Mass266.17
IUPAC NameN-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide
SMILESCn1ccnc1CNC(=O)CCOC1CCNCC1
InChIInChI=1S/C13H22N4O2/c1-17-8-7-15-12(17)10-16-13(18)4-9-19-11-2-5-14-6-3-11/h7-8,11,14H,2-6,9-10H2,1H3,(H,16,18)
InChIKeyQROJZLUCOZCZAP-UHFFFAOYSA-N
XLogP0.19
TPSA68.18 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 50.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

3-piperidin-4-yloxy-N-(pyridin-4-ylmethyl)propanamide
CID 63875784
3-piperidin-4-yloxy-N-(1,3-thiazol-4-ylmethyl)propanamide
CID 55251350
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 106371168
N-(1-methylpyrazol-3-yl)-3-piperidin-4-yloxypropanamide
CID 63876313
N-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]-3-piperidin-4-yloxypropanamide
CID 63877202
N-[(1-methylimidazol-2-yl)methyl]-3-(propan-2-ylamino)propanamide
CID 63293461
N-(2,3-dimethylbutyl)-3-piperidin-4-yloxypropanamide
CID 64599298
4-methyl-N-[(1-methylimidazol-2-yl)methyl]piperidine-4-carboxamide
CID 63293989
3-piperidin-4-yloxy-N-(thiophen-3-ylmethyl)propanamide
CID 63905466
N-(1-methylpiperidin-4-yl)-3-piperidin-4-yloxypropanamide
CID 55251133
(2S)-N-[(1-methylimidazol-2-yl)methyl]pyrrolidine-2-carboxamide
CID 63293809
N-[(1-methylimidazol-2-yl)methyl]-2-piperazin-1-ylpropanamide
CID 55171775

Frequently Asked Questions

What is the IUPAC name of N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide?
The IUPAC name of N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide (CID 63902997) is N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide.
What is the SMILES notation for N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide?
The canonical SMILES for N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide is Cn1ccnc1CNC(=O)CCOC1CCNCC1.
What is the InChIKey of N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide?
The InChIKey is QROJZLUCOZCZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O2/c1-17-8-7-15-12(17)10-16-13(18)4-9-19-11-2-5-14-6-3-11/h7-8,11,14H,2-6,9-10H2,1H3,(H,16,18).
What are the key properties of N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide?
N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide has a molecular weight of 266.34 g/mol, XLogP of 0.19, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-methylimidazol-2-yl)methyl]-3-piperidin-4-yloxypropanamide is sourced from PubChem (CID 63902997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).