4-amino-N-(3-propoxypropyl)pentanamide

C11H24N2O2 — CID 82942655

IUPAC4-amino-N-(3-propoxypropyl)pentanamide
SMILESCCCOCCCNC(=O)CCC(C)N
InChIInChI=1S/C11H24N2O2/c1-3-8-15-9-4-7-13-11(14)6-5-10(2)12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyPUDDNYHILZCQLC-UHFFFAOYSA-N
MW216.32 g/mol
LogP1.05
Rot. Bonds9

About 4-amino-N-(3-propoxypropyl)pentanamide

4-amino-N-(3-propoxypropyl)pentanamide (PubChem CID 82942655) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 4-amino-N-(3-propoxypropyl)pentanamide.

Molecular Properties

Compound Name4-amino-N-(3-propoxypropyl)pentanamide
PubChem CID82942655
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name4-amino-N-(3-propoxypropyl)pentanamide
SMILESCCCOCCCNC(=O)CCC(C)N
InChIInChI=1S/C11H24N2O2/c1-3-8-15-9-4-7-13-11(14)6-5-10(2)12/h10H,3-9,12H2,1-2H3,(H,13,14)
InChIKeyPUDDNYHILZCQLC-UHFFFAOYSA-N
XLogP1.05
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-amino-N-(3-ethoxypropyl)pentanamide;hydrochloride
CID 120558779
4-(2-aminoethyl)-N-(3-propoxypropyl)heptanamide
CID 82941851
4-(2-aminoethyl)-5-methyl-N-(3-propoxypropyl)hexanamide
CID 82941854
N'-(3-propoxypropyl)butanediamide
CID 153375512
(4R)-4-amino-N-propylpentanamide
CID 146234117
4-amino-N-(3-propan-2-yloxypropyl)pentanamide;hydrochloride
CID 120558859
5-oxo-5-(3-propoxypropylamino)pentanoic acid
CID 82941574
N'-(3-butoxypropyl)-N-butylbutanediamide
CID 4602776
5-amino-N-[3-(cyclopropylmethoxy)propyl]hexanamide
CID 82848964
N-(3-methylbutyl)-3-(2-propoxyethoxy)propanamide
CID 167117369
N'-(3-butoxypropyl)-N-heptylbutanediamide
CID 5116303
2-methoxy-N-(3-propoxypropyl)acetamide
CID 82947081

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(3-propoxypropyl)pentanamide?
The IUPAC name of 4-amino-N-(3-propoxypropyl)pentanamide (CID 82942655) is 4-amino-N-(3-propoxypropyl)pentanamide.
What is the SMILES notation for 4-amino-N-(3-propoxypropyl)pentanamide?
The canonical SMILES for 4-amino-N-(3-propoxypropyl)pentanamide is CCCOCCCNC(=O)CCC(C)N.
What is the InChIKey of 4-amino-N-(3-propoxypropyl)pentanamide?
The InChIKey is PUDDNYHILZCQLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-3-8-15-9-4-7-13-11(14)6-5-10(2)12/h10H,3-9,12H2,1-2H3,(H,13,14).
What are the key properties of 4-amino-N-(3-propoxypropyl)pentanamide?
4-amino-N-(3-propoxypropyl)pentanamide has a molecular weight of 216.32 g/mol, XLogP of 1.05, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(3-propoxypropyl)pentanamide is sourced from PubChem (CID 82942655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).