N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide

C16H31N3O — CID 63304196

IUPACN-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide
SMILESCCCN(CCC(=O)NC1CCCCC1)C1CCNC1
InChIInChI=1S/C16H31N3O/c1-2-11-19(15-8-10-17-13-15)12-9-16(20)18-14-6-4-3-5-7-14/h14-15,17H,2-13H2,1H3,(H,18,20)
InChIKeyICXVXEXFSORFBH-UHFFFAOYSA-N
MW281.44 g/mol
LogP1.90
Rot. Bonds7

About N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide

N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide (PubChem CID 63304196) has the molecular formula C16H31N3O and a molecular weight of 281.44 g/mol. Its IUPAC name is N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide.

Molecular Properties

Compound NameN-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide
PubChem CID63304196
Molecular FormulaC16H31N3O
Molecular Weight281.44 g/mol
Exact Mass281.25
IUPAC NameN-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide
SMILESCCCN(CCC(=O)NC1CCCCC1)C1CCNC1
InChIInChI=1S/C16H31N3O/c1-2-11-19(15-8-10-17-13-15)12-9-16(20)18-14-6-4-3-5-7-14/h14-15,17H,2-13H2,1H3,(H,18,20)
InChIKeyICXVXEXFSORFBH-UHFFFAOYSA-N
XLogP1.90
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.44
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-cyclopropyl-3-[ethyl(pyrrolidin-3-yl)amino]propanamide
CID 63300096
N-cycloheptyl-2-[piperidin-4-yl(propyl)amino]acetamide;hydrochloride
CID 119933007
N-(4-methylcyclohexyl)-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921661
N-cyclohexyl-3-(dipropylamino)propanamide
CID 109014002
N-cyclohexyl-2-[methyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119922828
N'-acetyl-2-[propyl(pyrrolidin-3-yl)amino]acetohydrazide
CID 63300602
N-(2,6-dichlorophenyl)-3-[propyl(pyrrolidin-3-yl)amino]propanamide
CID 119921476
N-propan-2-yl-2-[propyl(pyrrolidin-3-yl)amino]acetamide;hydrochloride
CID 119921653
2-[azetidin-3-yl(propyl)amino]-N-cyclopropylacetamide
CID 66216105
N-cyclooctylbutanamide
CID 4614062
3-cyclopropyl-1-propyl-1-pyrrolidin-3-ylurea
CID 62699859
N-piperidin-4-yl-N',N'-dipropylbutanediamide
CID 119386125

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide?
The IUPAC name of N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide (CID 63304196) is N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide.
What is the SMILES notation for N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide?
The canonical SMILES for N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide is CCCN(CCC(=O)NC1CCCCC1)C1CCNC1.
What is the InChIKey of N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide?
The InChIKey is ICXVXEXFSORFBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31N3O/c1-2-11-19(15-8-10-17-13-15)12-9-16(20)18-14-6-4-3-5-7-14/h14-15,17H,2-13H2,1H3,(H,18,20).
What are the key properties of N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide?
N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide has a molecular weight of 281.44 g/mol, XLogP of 1.90, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-3-[propyl(pyrrolidin-3-yl)amino]propanamide is sourced from PubChem (CID 63304196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).