N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide

C15H24N4O — CID 136573782

IUPACN-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(Cc2cnc[nH]2)CC1)NCC1CC1
InChIInChI=1S/C15H24N4O/c20-15(17-8-13-1-2-13)10-19-5-3-12(4-6-19)7-14-9-16-11-18-14/h9,11-13H,1-8,10H2,(H,16,18)(H,17,20)
InChIKeyLQSDQBJYVGVVAB-UHFFFAOYSA-N
MW276.38 g/mol
LogP1.19
Rot. Bonds6

About N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide

N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide (PubChem CID 136573782) has the molecular formula C15H24N4O and a molecular weight of 276.38 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide
PubChem CID136573782
Molecular FormulaC15H24N4O
Molecular Weight276.38 g/mol
Exact Mass276.20
IUPAC NameN-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide
SMILESO=C(CN1CCC(Cc2cnc[nH]2)CC1)NCC1CC1
InChIInChI=1S/C15H24N4O/c20-15(17-8-13-1-2-13)10-19-5-3-12(4-6-19)7-14-9-16-11-18-14/h9,11-13H,1-8,10H2,(H,16,18)(H,17,20)
InChIKeyLQSDQBJYVGVVAB-UHFFFAOYSA-N
XLogP1.19
TPSA61.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 51.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide (CID 136573782) is N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide is O=C(CN1CCC(Cc2cnc[nH]2)CC1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide?
The InChIKey is LQSDQBJYVGVVAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N4O/c20-15(17-8-13-1-2-13)10-19-5-3-12(4-6-19)7-14-9-16-11-18-14/h9,11-13H,1-8,10H2,(H,16,18)(H,17,20).
What are the key properties of N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide?
N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide has a molecular weight of 276.38 g/mol, XLogP of 1.19, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[4-(1H-imidazol-5-ylmethyl)piperidin-1-yl]acetamide is sourced from PubChem (CID 136573782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).