N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride

C10H21ClN2O — CID 175666343

IUPACN-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride
SMILESCCCCC(=O)NC[C@H]1CCCN1.Cl
InChIInChI=1S/C10H20N2O.ClH/c1-2-3-6-10(13)12-8-9-5-4-7-11-9;/h9,11H,2-8H2,1H3,(H,12,13);1H/t9-;/m1./s1
InChIKeyIHTVHVVMNVMDEV-SBSPUUFOSA-N
MW220.74 g/mol
LogP1.47
Rot. Bonds5

About N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride

N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride (PubChem CID 175666343) has the molecular formula C10H21ClN2O and a molecular weight of 220.74 g/mol. Its IUPAC name is N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride.

Molecular Properties

Compound NameN-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride
PubChem CID175666343
Molecular FormulaC10H21ClN2O
Molecular Weight220.74 g/mol
Exact Mass220.13
IUPAC NameN-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride
SMILESCCCCC(=O)NC[C@H]1CCCN1.Cl
InChIInChI=1S/C10H20N2O.ClH/c1-2-3-6-10(13)12-8-9-5-4-7-11-9;/h9,11H,2-8H2,1H3,(H,12,13);1H/t9-;/m1./s1
InChIKeyIHTVHVVMNVMDEV-SBSPUUFOSA-N
XLogP1.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.74
LogP ≤ 51.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(dipropylamino)-N-(pyrrolidin-2-ylmethyl)butanamide
CID 119511522
N',N'-dipropyl-N-(pyrrolidin-2-ylmethyl)pentanediamide;hydrochloride
CID 119514735
N',N'-dipropyl-N-(pyrrolidin-2-ylmethyl)pentanediamide
CID 119514736
1-butyl-3-(pyrrolidin-2-ylmethyl)urea
CID 62540044
N-[2-[(2R)-pyrrolidin-2-yl]ethyl]dodecanamide
CID 104971837
2-propylsulfonyl-N-(pyrrolidin-2-ylmethyl)acetamide;hydrochloride
CID 119510423
N-[(3-ethylpiperidin-2-yl)methyl]pentanamide
CID 82735090
N-(2-pyrrolidin-2-ylethyl)octanamide
CID 114793852
4-hydroxy-N-[[(2R)-pyrrolidin-2-yl]methyl]pent-4-enamide
CID 177056000
3-butyl-N-[[(2R)-pyrrolidin-2-yl]methyl]octanamide
CID 70821146
3-butyl-N-[[(2S)-pyrrolidin-2-yl]methyl]octanamide
CID 70821149
3-ethyl-N-(pyrrolidin-2-ylmethyl)pentanamide;hydrochloride
CID 119511693

Frequently Asked Questions

What is the IUPAC name of N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride?
The IUPAC name of N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride (CID 175666343) is N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride.
What is the SMILES notation for N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride?
The canonical SMILES for N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride is CCCCC(=O)NC[C@H]1CCCN1.Cl.
What is the InChIKey of N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride?
The InChIKey is IHTVHVVMNVMDEV-SBSPUUFOSA-N. The full InChI is InChI=1S/C10H20N2O.ClH/c1-2-3-6-10(13)12-8-9-5-4-7-11-9;/h9,11H,2-8H2,1H3,(H,12,13);1H/t9-;/m1./s1.
What are the key properties of N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride?
N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride has a molecular weight of 220.74 g/mol, XLogP of 1.47, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(2R)-pyrrolidin-2-yl]methyl]pentanamide;hydrochloride is sourced from PubChem (CID 175666343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).