N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine

C16H30N4O — CID 79057876

IUPACN,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine
SMILESCCCn1cc(C(NC)C(C)(CC)N2CCOCC2)cn1
InChIInChI=1S/C16H30N4O/c1-5-7-20-13-14(12-18-20)15(17-4)16(3,6-2)19-8-10-21-11-9-19/h12-13,15,17H,5-11H2,1-4H3
InChIKeyNMAPJODUBDSNPG-UHFFFAOYSA-N
MW294.44 g/mol
LogP2.05
Rot. Bonds7

About N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine

N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine (PubChem CID 79057876) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine.

Molecular Properties

Compound NameN,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine
PubChem CID79057876
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC NameN,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine
SMILESCCCn1cc(C(NC)C(C)(CC)N2CCOCC2)cn1
InChIInChI=1S/C16H30N4O/c1-5-7-20-13-14(12-18-20)15(17-4)16(3,6-2)19-8-10-21-11-9-19/h12-13,15,17H,5-11H2,1-4H3
InChIKeyNMAPJODUBDSNPG-UHFFFAOYSA-N
XLogP2.05
TPSA42.32 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine
CID 79065855
1-(4-bromo-1-ethylpyrazol-5-yl)-N,2-dimethyl-2-morpholin-4-ylbutan-1-amine
CID 114656870
1-(3-chlorophenyl)-N,2-dimethyl-2-morpholin-4-ylbutan-1-amine
CID 79065335
N-ethyl-2-methyl-2-morpholin-4-yl-1-pyrimidin-5-ylbutan-1-amine
CID 79064967
[2,2-dimethyl-1-(1-propylpyrazol-4-yl)propyl]hydrazine
CID 105203000
N-methyl-2-propyl-1-(1-propylpyrazol-4-yl)pentan-1-amine
CID 115807187
N,3,3-trimethyl-1-(1-propylpyrazol-4-yl)butan-1-amine
CID 63891510
1-(4-bromo-1-propylpyrazol-5-yl)-2-methyl-2-morpholin-4-ylbutan-1-amine
CID 114656867
4-methyl-1-(1-methylpyrazol-4-yl)-4-morpholin-4-ylhexan-3-amine
CID 103011088
1-(5-bromo-3-pyridinyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
CID 104802978
1-(2-fluorophenyl)-N,3-dimethyl-3-morpholin-4-ylpentan-2-amine
CID 79057627
[1-(furan-3-yl)-2-methyl-2-morpholin-4-ylbutyl]hydrazine
CID 105241578

Frequently Asked Questions

What is the IUPAC name of N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine?
The IUPAC name of N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine (CID 79057876) is N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine.
What is the SMILES notation for N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine?
The canonical SMILES for N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine is CCCn1cc(C(NC)C(C)(CC)N2CCOCC2)cn1.
What is the InChIKey of N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine?
The InChIKey is NMAPJODUBDSNPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-5-7-20-13-14(12-18-20)15(17-4)16(3,6-2)19-8-10-21-11-9-19/h12-13,15,17H,5-11H2,1-4H3.
What are the key properties of N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine?
N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine has a molecular weight of 294.44 g/mol, XLogP of 2.05, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,2-dimethyl-2-morpholin-4-yl-1-(1-propylpyrazol-4-yl)butan-1-amine is sourced from PubChem (CID 79057876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).