N-(3-aminopropyl)-2-methyl-N-propylpropanamide

C10H22N2O — CID 43136612

IUPACN-(3-aminopropyl)-2-methyl-N-propylpropanamide
SMILESCCCN(CCCN)C(=O)C(C)C
InChIInChI=1S/C10H22N2O/c1-4-7-12(8-5-6-11)10(13)9(2)3/h9H,4-8,11H2,1-3H3
InChIKeyRRCCQPCODPMFLE-UHFFFAOYSA-N
MW186.30 g/mol
LogP1.23
Rot. Bonds6

About N-(3-aminopropyl)-2-methyl-N-propylpropanamide

N-(3-aminopropyl)-2-methyl-N-propylpropanamide (PubChem CID 43136612) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N-(3-aminopropyl)-2-methyl-N-propylpropanamide.

Molecular Properties

Compound NameN-(3-aminopropyl)-2-methyl-N-propylpropanamide
PubChem CID43136612
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN-(3-aminopropyl)-2-methyl-N-propylpropanamide
SMILESCCCN(CCCN)C(=O)C(C)C
InChIInChI=1S/C10H22N2O/c1-4-7-12(8-5-6-11)10(13)9(2)3/h9H,4-8,11H2,1-3H3
InChIKeyRRCCQPCODPMFLE-UHFFFAOYSA-N
XLogP1.23
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 51.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3-aminopropyl)-3-methyl-2-propan-2-yl-N-propylbutanamide
CID 114282132
N-(2-bromoethyl)-2-methyl-N-propylpropanamide
CID 80660221
N-(3-aminopropyl)-N-propylprop-2-enamide
CID 150203035
N-(3-aminopropyl)-N-ethyl-2-propylpentanamide
CID 82984398
5-amino-N,N-dihexyl-2-methylpentanamide
CID 104684478
N-(2-aminoethyl)-2-ethyl-N-propylbutanamide
CID 61349350
N-(3-aminopropyl)-N-propylnonanamide
CID 65448334
4-amino-2-methyl-N,N-dipentylbutanamide
CID 80542996
N-(3-aminopropyl)-3,3-dimethyl-N-propylbutanamide
CID 43136576
(2S)-2-amino-3-methyl-N,N-dipropylbutanamide
CID 22690786
4-amino-N,N-dipropylbutanamide
CID 12835718
2-[(5-amino-2-methylpentanoyl)-propylamino]acetic acid
CID 115867094

Frequently Asked Questions

What is the IUPAC name of N-(3-aminopropyl)-2-methyl-N-propylpropanamide?
The IUPAC name of N-(3-aminopropyl)-2-methyl-N-propylpropanamide (CID 43136612) is N-(3-aminopropyl)-2-methyl-N-propylpropanamide.
What is the SMILES notation for N-(3-aminopropyl)-2-methyl-N-propylpropanamide?
The canonical SMILES for N-(3-aminopropyl)-2-methyl-N-propylpropanamide is CCCN(CCCN)C(=O)C(C)C.
What is the InChIKey of N-(3-aminopropyl)-2-methyl-N-propylpropanamide?
The InChIKey is RRCCQPCODPMFLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-7-12(8-5-6-11)10(13)9(2)3/h9H,4-8,11H2,1-3H3.
What are the key properties of N-(3-aminopropyl)-2-methyl-N-propylpropanamide?
N-(3-aminopropyl)-2-methyl-N-propylpropanamide has a molecular weight of 186.30 g/mol, XLogP of 1.23, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminopropyl)-2-methyl-N-propylpropanamide is sourced from PubChem (CID 43136612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).