N-(4-aminocyclohexyl)-3-(methylamino)propanamide

C10H21N3O — CID 62319076

IUPACN-(4-aminocyclohexyl)-3-(methylamino)propanamide
SMILESCNCCC(=O)NC1CCC(N)CC1
InChIInChI=1S/C10H21N3O/c1-12-7-6-10(14)13-9-4-2-8(11)3-5-9/h8-9,12H,2-7,11H2,1H3,(H,13,14)
InChIKeyYEHQZQDWZAOUOS-UHFFFAOYSA-N
MW199.30 g/mol
LogP-0.02
Rot. Bonds4

About N-(4-aminocyclohexyl)-3-(methylamino)propanamide

N-(4-aminocyclohexyl)-3-(methylamino)propanamide (PubChem CID 62319076) has the molecular formula C10H21N3O and a molecular weight of 199.30 g/mol. Its IUPAC name is N-(4-aminocyclohexyl)-3-(methylamino)propanamide.

Molecular Properties

Compound NameN-(4-aminocyclohexyl)-3-(methylamino)propanamide
PubChem CID62319076
Molecular FormulaC10H21N3O
Molecular Weight199.30 g/mol
Exact Mass199.17
IUPAC NameN-(4-aminocyclohexyl)-3-(methylamino)propanamide
SMILESCNCCC(=O)NC1CCC(N)CC1
InChIInChI=1S/C10H21N3O/c1-12-7-6-10(14)13-9-4-2-8(11)3-5-9/h8-9,12H,2-7,11H2,1H3,(H,13,14)
InChIKeyYEHQZQDWZAOUOS-UHFFFAOYSA-N
XLogP-0.02
TPSA67.15 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.30
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 79462547
3-[(3-aminocyclobutyl)amino]-N-cyclopropylpropanamide
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N-cyclopropyl-3-[[3-(cyclopropylamino)-3-oxopropyl]amino]propanamide
CID 79394765
N-(4-aminocyclohexyl)-5-bromopentanamide
CID 107909975
N-(4-aminocyclohexyl)-3-cyclopentylpropanamide;hydrochloride
CID 119260252
N-(4-aminocyclohexyl)-3-ethoxypropanamide;hydrochloride
CID 119475217
N,N'-dicyclopropylbutanediamide
CID 5225156
3-(4-aminocyclohexyl)-N-(4-hydroxycyclohexyl)propanamide
CID 62776158
N-(4-aminocyclohexyl)hex-5-enamide
CID 119478568
N-(4-aminocyclohexyl)-2-(dimethylamino)acetamide;dihydrochloride
CID 86277381
N-cyclopropyl-4-(methylcarbamoylamino)butanamide
CID 115582642
N-(4-aminocyclohexyl)-2-(propan-2-ylamino)acetamide
CID 62319444

Frequently Asked Questions

What is the IUPAC name of N-(4-aminocyclohexyl)-3-(methylamino)propanamide?
The IUPAC name of N-(4-aminocyclohexyl)-3-(methylamino)propanamide (CID 62319076) is N-(4-aminocyclohexyl)-3-(methylamino)propanamide.
What is the SMILES notation for N-(4-aminocyclohexyl)-3-(methylamino)propanamide?
The canonical SMILES for N-(4-aminocyclohexyl)-3-(methylamino)propanamide is CNCCC(=O)NC1CCC(N)CC1.
What is the InChIKey of N-(4-aminocyclohexyl)-3-(methylamino)propanamide?
The InChIKey is YEHQZQDWZAOUOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21N3O/c1-12-7-6-10(14)13-9-4-2-8(11)3-5-9/h8-9,12H,2-7,11H2,1H3,(H,13,14).
What are the key properties of N-(4-aminocyclohexyl)-3-(methylamino)propanamide?
N-(4-aminocyclohexyl)-3-(methylamino)propanamide has a molecular weight of 199.30 g/mol, XLogP of -0.02, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-aminocyclohexyl)-3-(methylamino)propanamide is sourced from PubChem (CID 62319076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).