N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide

C16H29N3O — CID 65242656

IUPACN-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide
SMILESCNC1(CC(=O)NC2CCN(C3CC3)C2)CCCCC1
InChIInChI=1S/C16H29N3O/c1-17-16(8-3-2-4-9-16)11-15(20)18-13-7-10-19(12-13)14-5-6-14/h13-14,17H,2-12H2,1H3,(H,18,20)
InChIKeyGVHBXNWJQFKIOB-UHFFFAOYSA-N
MW279.43 g/mol
LogP1.65
Rot. Bonds5

About N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide

N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide (PubChem CID 65242656) has the molecular formula C16H29N3O and a molecular weight of 279.43 g/mol. Its IUPAC name is N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide.

Molecular Properties

Compound NameN-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide
PubChem CID65242656
Molecular FormulaC16H29N3O
Molecular Weight279.43 g/mol
Exact Mass279.23
IUPAC NameN-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide
SMILESCNC1(CC(=O)NC2CCN(C3CC3)C2)CCCCC1
InChIInChI=1S/C16H29N3O/c1-17-16(8-3-2-4-9-16)11-15(20)18-13-7-10-19(12-13)14-5-6-14/h13-14,17H,2-12H2,1H3,(H,18,20)
InChIKeyGVHBXNWJQFKIOB-UHFFFAOYSA-N
XLogP1.65
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.43
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-(methylamino)cyclohexyl]-N-(1-methylpiperidin-4-yl)acetamide
CID 65240925
2-[1-(aminomethyl)cyclohexyl]-N-(1-cyclopropylpyrrolidin-3-yl)acetamide
CID 104678068
N-(1,1-dioxothiolan-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240476
1-amino-N-(1-cyclopropylpyrrolidin-3-yl)cyclohexane-1-carboxamide;dihydrochloride
CID 119864838
2-[1-(aminomethyl)cyclohexyl]-N-(1-cyclopropylpiperidin-4-yl)acetamide
CID 104677721
N-(1-azabicyclo[2.2.2]octan-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240963
N-(1-cyclopropylpyrrolidin-3-yl)azepane-1-carboxamide
CID 115629328
N-[(1S,2S)-2-hydroxycyclohexyl]-2-[1-(methylamino)cyclohexyl]acetamide
CID 107221672
1-cyclobutyl-3-(1-cyclopropylpyrrolidin-3-yl)urea
CID 115629326
N-(1-cyclopropylethyl)-2-[1-(methylamino)cyclohexyl]acetamide
CID 65240682
1-[(1-cyclopropylpyrrolidin-3-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62097146
methyl N-(1-cyclohexylpyrrolidin-3-yl)carbamate
CID 110477693

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide?
The IUPAC name of N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide (CID 65242656) is N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide.
What is the SMILES notation for N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide?
The canonical SMILES for N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide is CNC1(CC(=O)NC2CCN(C3CC3)C2)CCCCC1.
What is the InChIKey of N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide?
The InChIKey is GVHBXNWJQFKIOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H29N3O/c1-17-16(8-3-2-4-9-16)11-15(20)18-13-7-10-19(12-13)14-5-6-14/h13-14,17H,2-12H2,1H3,(H,18,20).
What are the key properties of N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide?
N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide has a molecular weight of 279.43 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpyrrolidin-3-yl)-2-[1-(methylamino)cyclohexyl]acetamide is sourced from PubChem (CID 65242656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).