N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide

C12H22N2O2 — CID 65109211

IUPACN-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide
SMILESO=C(CNCC1(O)CCCC1)NCC1CC1
InChIInChI=1S/C12H22N2O2/c15-11(14-7-10-3-4-10)8-13-9-12(16)5-1-2-6-12/h10,13,16H,1-9H2,(H,14,15)
InChIKeySWQBXLVLLCCSFX-UHFFFAOYSA-N
MW226.32 g/mol
LogP0.41
Rot. Bonds6

About N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide

N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide (PubChem CID 65109211) has the molecular formula C12H22N2O2 and a molecular weight of 226.32 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide
PubChem CID65109211
Molecular FormulaC12H22N2O2
Molecular Weight226.32 g/mol
Exact Mass226.17
IUPAC NameN-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide
SMILESO=C(CNCC1(O)CCCC1)NCC1CC1
InChIInChI=1S/C12H22N2O2/c15-11(14-7-10-3-4-10)8-13-9-12(16)5-1-2-6-12/h10,13,16H,1-9H2,(H,14,15)
InChIKeySWQBXLVLLCCSFX-UHFFFAOYSA-N
XLogP0.41
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.32
LogP ≤ 50.41
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide?
The IUPAC name of N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide (CID 65109211) is N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide.
What is the SMILES notation for N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide?
The canonical SMILES for N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide is O=C(CNCC1(O)CCCC1)NCC1CC1.
What is the InChIKey of N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide?
The InChIKey is SWQBXLVLLCCSFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O2/c15-11(14-7-10-3-4-10)8-13-9-12(16)5-1-2-6-12/h10,13,16H,1-9H2,(H,14,15).
What are the key properties of N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide?
N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide has a molecular weight of 226.32 g/mol, XLogP of 0.41, 6 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-2-[(1-hydroxycyclopentyl)methylamino]acetamide is sourced from PubChem (CID 65109211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).